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Chemistry

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Also known as: 652-37-9, Theophylline-7-acetic acid, Acephylline, Theophyllineacetic acid, Carboxymethyltheophylline, Theophyllin-7-ylacetic acid
Molecular Formula
C9H10N4O4
Molecular Weight
238.20  g/mol
InChI Key
HCYFGRCYSCXKNQ-UHFFFAOYSA-N
FDA UNII
M494UE2YEP

Acefylline
acefylline is a natural product found in Pogostemon cablin with data available.
1 2D Structure

Acefylline

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid
2.1.2 InChI
InChI=1S/C9H10N4O4/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)
2.1.3 InChI Key
HCYFGRCYSCXKNQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O
2.2 Other Identifiers
2.2.1 UNII
M494UE2YEP
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 7-theophyllineacetic Acid

2. Acefylline, Sodium Salt

3. Acephylline

4. Theophylline-7-acetic Acid

2.3.2 Depositor-Supplied Synonyms

1. 652-37-9

2. Theophylline-7-acetic Acid

3. Acephylline

4. Theophyllineacetic Acid

5. Carboxymethyltheophylline

6. Theophyllin-7-ylacetic Acid

7. 7-(carboxymethyl)theophylline

8. 7-theophyllineacetic Acid

9. 7-theophyllinylacetic Acid

10. 1,3-dimethylxanthine-7-acetic Acid

11. Nsc 52996

12. (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)acetic Acid

13. 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic Acid

14. Purine-7-acetic Acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

15. Caffeine Carboxylic Acid

16. 2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1h-purin-7(6h)-yl)acetic Acid

17. Mfcd00022832

18. Nsc-52996

19. Doxophylline Metabolite M2

20. M494ue2yep

21. 7h-purine-7-acetic Acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

22. Chembl70246

23. 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-acetic Acid

24. 2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-7-yl)acetic Acid

25. 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)acetic Acid

26. 7-theophyllinessigsaeure

27. 7-theophyllinylessigsaeure

28. Einecs 211-490-2

29. Unii-m494ue2yep

30. Brn 0279221

31. Acide Theophylline-ethanoique-7 [french]

32. Acide Theophylline-ethanoique-7

33. Acetyloxytheophylline

34. Aminodal (salt/mix)

35. Theophylline-acetic Acid

36. Acefylline [mi]

37. Acepifylline (salt/mix)

38. Theophylline 7-acetic Acid

39. Ec 211-490-2

40. 2-(p-chlorphenoxy)-2-methylpropyl 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-acetate

41. Acefylline [who-dd]

42. Dsstox_cid_31585

43. Dsstox_rid_97469

44. Dsstox_gsid_57796

45. Oprea1_398884

46. 5-26-14-00088 (beilstein Handbook Reference)

47. Mls001032052

48. Schembl308514

49. Lczc2430

50. Dtxsid6057796

51. Chebi:94615

52. Zinc57633

53. Hms3714e15

54. Hms3885c16

55. Acefylline Sodium Salt (salt/mix)

56. Hy-b1505

57. Nsc52996

58. Tox21_113765

59. Bbl027883

60. Bdbm50113248

61. Stk801809

62. 7h-purine-7-aceticacid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

63. Akos000120359

64. Caffeine Carboxylic Acid [inci]

65. Ccg-106578

66. Cs-7963

67. Db13573

68. Ncgc00253638-01

69. Cas-652-37-9

70. Smr000718632

71. Ts-00694

72. Db-054784

73. Ft-0632754

74. S3988

75. T2941

76. Theophylline-7-acetic Acid, >=99.0% (t)

77. A16822

78. D82360

79. A835035

80. Af-684/00246037

81. Sr-01000898401

82. 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)acetic Acid

83. Q-201818

84. Q4673059

85. Sr-01000898401-2

86. F0849-4607

87. Z112207552

88. Acefylline;theophyllineacetic Acid; Theophylline-7-acetic Acid

89. Theophilline-7-acetic Acid (1,3-dimethylxantine-7-acetic Acid)

90. 7h-purine-7-acetic Acid,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

91. Purine-7-acetic Acid,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-

92. (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)acetic Acid #

93. (1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl)-acetic Acid

94. 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-acetic A

95. 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7h-purin-7-yl)aceticacid

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 238.20 g/mol
Molecular Formula C9H10N4O4
XLogP3-0.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass238.07020481 g/mol
Monoisotopic Mass238.07020481 g/mol
Topological Polar Surface Area95.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity385
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API SUPPLIERS

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Globofarm International

India

USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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Globofarm International

India

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S.S.Pharmachem

India

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Kores India Limited

India

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Kores India Limited

India

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Mangalmurti Bio-chem

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Bajaj Healthcare

India

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Bajaj Healthcare

India

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01

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acephylline IH

Date of Issue : 2021-06-14

Valid Till : 2024-06-13

Written Confirmation Number : WC-0277A2

Address of the Firm : Unit -2, Block No.588, Savli Karachia Road, At & Post- Gothada, Dist Vadodara, G...

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02

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Acefylline (IH)

Date of Issue : 2016-08-10

Valid Till : 2019-07-02

Written Confirmation Number : WC-0196

Address of the Firm : Factory: No. 58/1, 58/2, 59/A, 65A, 65/B, 65C, 66-A, MIDC Industrial Area, Dhata...

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Listed Suppliers

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01

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Acefylline

About the Company : Bajaj Healthcare Ltd. is a company established in 1993, services various Pharmaceuticals, Nutraceutical and Food industries globally with a spirit of scrupulousness. Bajaj Healt...

Bajaj Healthcare Ltd. is a company established in 1993, services various Pharmaceuticals, Nutraceutical and Food industries globally with a spirit of scrupulousness. Bajaj Healthcare Ltd. have metamorphosed into specialty company and focused on development, manufacturing and supply of Amino Acids, Nutritional Supplements and Active Pharmaceutical Ingredients (API) for Pharmaceutical, Nutraceuticals and Food industries. Bajaj healthcare Ltd. in its shot life span has gained loyalty from national and international customers and our products enjoy good fame in the overseas market.
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02

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Acefylline

About the Company : Globofarm International Pvt Ltd is a well-informed, highly efficient, Swiftly functioning competitive sourcing entity. We serve private, institutional, and corporate clients worldw...

Globofarm International Pvt Ltd is a well-informed, highly efficient, Swiftly functioning competitive sourcing entity. We serve private, institutional, and corporate clients worldwide in the field of Pharmaceuticals & Nutraceuticals. We combine our contacts, expertise, and core competency with our operations to deliver superior pharmaceutical sourcing solutions to our customers. Having our base in India, Globofarm International Pvt Ltd has been serving clients globally.
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03

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Acefylline

About the Company : The division was established in 1981 as a Specialty Chemicals Division with a focus to manufacture specialty chemicals and pharmaceutical intermediates. In April 2006, the division...

The division was established in 1981 as a Specialty Chemicals Division with a focus to manufacture specialty chemicals and pharmaceutical intermediates. In April 2006, the division has been renamed as ‘Pharmaceuticals & Chemicals Division’ to focus strongly on the manufacturing of active pharmaceutical ingredients and pharmaceutical intermediates. Located at Roha, the manufacturing site is about 140 km from the city of Mumbai and occupies an area of 40,000 sq.m. The division employs over 200 people and has the capacity to develop and execute a range of chemical processes. It also provides for innovative process design and scale-up.
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04

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Acefylline

About the Company : Mangalmurti Bio-Chem Private Limited was established in 2010, initially focusing on the production of NPK fertilizer blends with a daily capacity of 200 tons. The company successfu...

Mangalmurti Bio-Chem Private Limited was established in 2010, initially focusing on the production of NPK fertilizer blends with a daily capacity of 200 tons. The company successfully supplied its products across Gujarat, Maharashtra, Rajasthan, and Madhya Pradesh. However, in recent years, market conditions have declined, and stricter government regulations have restricted access to key raw materials. With a strong focus on innovation and sustainability, the company embarked on this new path in 2015, aiming to develop high-quality organic and inorganic chemical compounds.
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05

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Acefylline

About the Company : S.S. PHARMACHEM is a professionally managed Bulk Drug & Chemical manufacturing unit headed by MR. SAGAR S. SANGEKAR & MR. SANJAY S. SANGEKAR. Established in 1987 & committed to dev...

S.S. PHARMACHEM is a professionally managed Bulk Drug & Chemical manufacturing unit headed by MR. SAGAR S. SANGEKAR & MR. SANJAY S. SANGEKAR. Established in 1987 & committed to development of import substitutes. S.S. PHARMACHEM has evolved into highly organized concern comprising of a sophisticated manufacturing complex at Tarapur (Maharashtra). Our Specialized product range has been well accepted by Indian as well as multinational companies. We also export our products to various countries. Our List of Customer include many customers all over the world in U.S.A, EUROPE, CANADA, SINGAPORE, TAIWAN, THAILAND, EGYPT, JORDAN, OMAN, NEPAL, PAKISTAN etc..... Also some of our local customers are multinationals like JOHNSON & JOHNSON, CIPLA, IPCA, INDOCO REMIDIES, AJANTA PHARMA, SHASUN CHEMICALS and many more. Our manufacturing facility has been Audited by companies like JOHNSON & JOHNSON, ABBOTT, IPCA, CIPLA, DR.REDDYS, SHASUN CHEMICALS and also some of our foreign buyers such as SANDOZ CANADA. One of our main products is Diphenhydramine Hcl, Diethyl Carbamazine Citrate, Ambroxol Hcl, Mephenesin, Dimenhydrinate, Maleic Acid. Please also see our attached product List for our entire product range and monthly capacity.
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05-Jan-2021
28-Mar-2025
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ABOUT THIS PAGE

Looking for 652-37-9 / Acefylline API manufacturers, exporters & distributors?

Acefylline manufacturers, exporters & distributors 1

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PharmaCompass offers a list of Acefylline API manufacturers, exporters & distributors, which can be sorted by GMP, USDMF, JDMF, KDMF, CEP (COS), WC, Price,and more, enabling you to easily find the right Acefylline manufacturer or Acefylline supplier for your needs.

Send us enquiries for free, and we will assist you in establishing a direct connection with your preferred Acefylline manufacturer or Acefylline supplier.

PharmaCompass also assists you with knowing the Acefylline API Price utilized in the formulation of products. Acefylline API Price is not always fixed or binding as the Acefylline Price is obtained through a variety of data sources. The Acefylline Price can also vary due to multiple factors, including market conditions, regulatory modifications, or negotiated pricing deals.

API | Excipient name

Acefylline

Synonyms

652-37-9, Theophylline-7-acetic acid, Acephylline, Theophyllineacetic acid, Carboxymethyltheophylline, Theophyllin-7-ylacetic acid

Cas Number

652-37-9

Unique Ingredient Identifier (UNII)

M494UE2YEP

About Acefylline

acefylline is a natural product found in Pogostemon cablin with data available.

Acefylline Manufacturers

A Acefylline manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Acefylline, including repackagers and relabelers. The FDA regulates Acefylline manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Acefylline API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

click here to find a list of Acefylline manufacturers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PhamaCompass.

Acefylline Suppliers

A Acefylline supplier is an individual or a company that provides Acefylline active pharmaceutical ingredient (API) or Acefylline finished formulations upon request. The Acefylline suppliers may include Acefylline API manufacturers, exporters, distributors and traders.

click here to find a list of Acefylline suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Acefylline WC

A Acefylline written confirmation (Acefylline WC) is an official document issued by a regulatory agency to a Acefylline manufacturer, verifying that the manufacturing facility of a Acefylline active pharmaceutical ingredient (API) adheres to the Good Manufacturing Practices (GMP) regulations of the importing country. When exporting Acefylline APIs or Acefylline finished pharmaceutical products to another nation, regulatory agencies frequently require a Acefylline WC (written confirmation) as part of the regulatory process.

click here to find a list of Acefylline suppliers with Written Confirmation (WC) on PharmaCompass.

Acefylline GMP

Acefylline Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Acefylline GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Acefylline GMP manufacturer or Acefylline GMP API supplier for your needs.

Acefylline CoA

A Acefylline CoA (Certificate of Analysis) is a formal document that attests to Acefylline's compliance with Acefylline specifications and serves as a tool for batch-level quality control.

Acefylline CoA mostly includes findings from lab analyses of a specific batch. For each Acefylline CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Acefylline may be tested according to a variety of international standards, such as European Pharmacopoeia (Acefylline EP), Acefylline JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Acefylline USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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