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Also known as: 1076-38-6, 4-coumarinol, Benzotetronic acid, 4-hydroxy-2h-chromen-2-one, 4-hydroxychromen-2-one, 2h-1-benzopyran-2-one, 4-hydroxy-
Molecular Formula
C9H6O3
Molecular Weight
162.14  g/mol
InChI Key
VXIXUWQIVKSKSA-UHFFFAOYSA-N
FDA UNII
X954ZLL2RD

CAS 1076-38-6
4-hydroxycoumarin is a natural product found in Vitis vinifera, Ruta graveolens, and Apis cerana with data available.
1 2D Structure

CAS 1076-38-6

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-hydroxychromen-2-one
2.1.2 InChI
InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
2.1.3 InChI Key
VXIXUWQIVKSKSA-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C2C(=C1)C(=CC(=O)O2)O
2.2 Other Identifiers
2.2.1 UNII
X954ZLL2RD
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 4-oh Coumarin

2.3.2 Depositor-Supplied Synonyms

1. 1076-38-6

2. 4-coumarinol

3. Benzotetronic Acid

4. 4-hydroxy-2h-chromen-2-one

5. 4-hydroxychromen-2-one

6. 2h-1-benzopyran-2-one, 4-hydroxy-

7. Coumarin, 4-hydroxy-

8. 4-hydroxy-2h-1-benzopyran-2-one

9. 4-hydroxy Coumarin

10. 4-hydroxy-chromen-2-one

11. 4-hydroxy-1-benzopyran-2-one

12. 4-hydroxy-2-chromenone

13. 2-hydroxychromone

14. Mfcd00006856

15. 4-hydroxy-2h-benzo[b]pyran-2-one

16. X954zll2rd

17. Chembl301141

18. 22105-09-5

19. Chebi:40070

20. Nsc11889

21. Nsc-11889

22. 4-hydroxy-2h-1-benzopyran-2-one (4-hydroxycoumarin)

23. 4-hydroxy-coumarin

24. 4- Hydroxycoumarin

25. 4hc

26. Einecs 214-060-2

27. Nsc 11889

28. 4h-1-benzopyran-4-one, 2-hydroxy-

29. Unii-x954zll2rd

30. Brn 0129768

31. Hydroxychromone

32. Ai3-52393

33. 4-hyroxycoumarin

34. 4-hydroxyl Coumarin

35. 4-monohydroxycoumarin

36. 4-hydroxycoumarin, 98%

37. Cbiol_000838

38. Wln: T66 Bovj Eq

39. 5-18-01-00378 (beilstein Handbook Reference)

40. Mls004491719

41. Schembl131312

42. Megxm0_000452

43. Schembl1961365

44. Dtxsid8061472

45. Acon1_001952

46. 4-hydroxy-2h-chromen-2-one #

47. Dtxsid50944748

48. Hms1607g02

49. 4-hydroxy-2-oxo-2h-1-benzopyran

50. 2-hydroxy-4h-1-benzopyran-4-one

51. Bcp31120

52. Hy-n6856

53. Str01861

54. Bbl027616

55. Bdbm50055710

56. Iccb4_000134

57. Stk801816

58. Zinc18154848

59. Zinc96006086

60. Akos000119142

61. Akos037515220

62. Am84328

63. Db03410

64. 4-hydroxycoumarin [usp Impurity]

65. Ncgc00179970-01

66. Ac-13227

67. Nci60_000453

68. Smr000112320

69. Sy001614

70. Db-014485

71. Bb 0220623

72. Cs-0015925

73. Eu-0066799

74. Ft-0602218

75. Ft-0660645

76. H0235

77. C20414

78. D71127

79. Warfarin Sodium Impurity B [ep Impurity]

80. 4-hydroxycoumarin, Vetec(tm) Reagent Grade, 98%

81. Sr-01000389319

82. J-515519

83. J-620003

84. Sr-01000389319-1

85. Brd-k48844111-001-01-4

86. Q25323691

87. Z56922074

88. 4-hydroxy-1-benzopyran-2-one; 4-hydroxycoumarin

89. F0266-2972

90. 4-hydroxy Coumarin;4-coumarinol;4-hydroxy-2h-chromen-2-one

2.4 Create Date
2011-12-26
3 Chemical and Physical Properties
Molecular Weight 162.14 g/mol
Molecular Formula C9H6O3
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass162.031694049 g/mol
Monoisotopic Mass162.031694049 g/mol
Topological Polar Surface Area46.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity232
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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SUPPLIERS

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01

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  • EDQM
  • WHO-GMP

Virtual BoothPanvo Organics: Advancing quality APIs and formulations with Halal, Kosher, US FDA, and WHO-approved manufacturing excellence.

4-hydroxycoumarin

CAS Number : 1076-38-6

End Use API :

About the Company : Panvo Organics Pvt. Ltd. is a WHO-GMP certified manufacturer of Active Pharmaceutical Ingredients, Novel Formulations, and Sustainable Agriculture Inputs. Our Halal- and Kosher-certifie...

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02

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothMalladi is a leader in Ephedrine, Pseudoephedrine Salts & Phenylephrine HCl // USFDA, EDQM, ANSM, KFDA, and TGA inspected.

N-(1-Benzyl-4-piperidinyl)-N-phenylpropanamide HCI

CAS Number : 1076-38-6

End Use API :

About the Company : Malladi Drugs & Pharmaceuticals Ltd, founded in 1980 by Mr. M L N Sastry, is a leader in manufacturing ephedrine and pseudoephedrine salts. It is now the top API manufacturer in the cou...

Malladi

03

  • fda
  • EDQM
  • WHO-GMP

Virtual BoothZeon Pharma is a manufacturer and supplier of APIs & Intermediates.

4 Hydroxy Coumarin

CAS Number : 1076-38-6

End Use API :

About the Company : Zeon Pharma Industries India Pvt. Ltd. is an ISO 9001:2015, cGMP, and WHO-GMP certified company with a dedicated manufacturing facility for Bulk Drugs (APIs), phytochemicals, herbal ext...

Zeon Pharma Industries India Pvt Ltd

04

BIO Partnering at JPM
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4-HYDROXY COUMARINE

CAS Number : 1076-38-6

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About the Company : Founded with a mission to transform strategic capital into specialty chemicals, Ami Group focuses on Agrochemicals, Cosmetics, and Polymers. Ami Organics Ltd. is committed to meeting yo...

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05

BIO Partnering at JPM
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4-Hydroxy Coumarin

CAS Number : 1076-38-6

End Use API :

About the Company : Anvitha Life Care Private Limited, founded in 2016 by Dr. T. Prakasam and a team of experienced scientists and technocrats with over 80 years of combined expertise, is located on a 17,6...

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06

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BIO Partnering at JPM
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4-Hydroxy Coumarin

CAS Number : 1076-38-6

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About the Company : Corey Organics is focused in developing and manufacturing of Active Pharmaceutical Ingredients (APIs), registered Pharma Intermediates, Fine Chemicals and Pyridine Derivatives for cater...

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BIO Partnering at JPM
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BIO Partnering at JPM
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4-Hydroxycoumarine

CAS Number : 1076-38-6

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About the Company : Maisuriya Pharma Solutions is a research-driven & technology-oriented company. Continuous innovations & improvement are the lifeblood of our business. Our major focus is to offer pharma...

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BIO Partnering at JPM
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BIO Partnering at JPM
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4-Hydroxy Coumarine

CAS Number : 1076-38-6

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About the Company : Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, Storage Fine Chemical Company in India which have specialty in Synthesis Molecul...

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BIO Partnering at JPM
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4-Hydroxy Coumarin

CAS Number : 93-35-6

End Use API :

About the Company : SLN Pharmachem was setup in 1997 with an objective to provide technology based products (Intermediates) for Pharmaceutical, Cosmetic and Fine Chemical Industry. SLN Pharmachem is an ISO...

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