CAS 114446-57-0

Chemistry, 1 End Use API, 2 Related Intermediates

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Also known as: 114446-57-0, (1r)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol, (r)-2-chloro-1-(2,4-dichlorophenyl)ethanol, (r)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol, Schembl7460986, Akos032950078

Molecular Formula

C₈H₇Cl₃O

Molecular Weight

225.5 g/mol

InChI Key

XHEPANNURIQWRM-QMMMGPOBSA-N

1 2D Structure

CAS 114446-57-0

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(1R)-2-chloro-1-(2,4-dichlorophenyl)ethanol

2.1.2 InChI

InChI=1S/C8H7Cl3O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3,8,12H,4H2/t8-/m0/s1

2.1.3 InChI Key

XHEPANNURIQWRM-QMMMGPOBSA-N

2.1.4 Canonical SMILES

C1=CC(=C(C=C1Cl)Cl)C(CCl)O

2.1.5 Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)[C@H](CCl)O

2.2 Synonyms

2.2.1 MeSH Synonyms

1. (r)-2-chloro-1-(2,4-dichlorophenyl)ethanol

2.2.2 Depositor-Supplied Synonyms

1. 114446-57-0

2. (1r)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol

3. (r)-2-chloro-1-(2,4-dichlorophenyl)ethanol

4. (r)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol

5. Schembl7460986

6. Akos032950078

7. As-69603

8. (r)-2,2',4'-trichloro-1-phenylethan-1-ol

9. En300-87664

10. (r)-2-chloro-(2',4'-dichlorophenyl)-1-ethanol

11. (r)-alpha-(chloromethyl)-2,4-dichlorobenzylalcohol

12. (r)-alpha-(chloromethyl)-2,4-dichlorobenzyl Alcohol

13. Benzenemethanol, 2,4-dichloro-alpha-(chloromethyl)-, (alphar)-

2.3 Create Date

2006-07-29

3 Chemical and Physical Properties

Molecular Formula	C₈H₇Cl₃O
Molecular Weight	225.5 g/mol
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	20.2
Heavy Atom Count	12
Formal Charge	0
Complexity	142
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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Virupaksha Organics

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India

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(S)-2-chloro-1-(2,4-dichlorophenyl)ethyl methanesulfona...

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CAS Number

229334-55-8

End Use API

Established in 2003 by G. Chandra Mouliswar Reddy, Virupaksha strives to supply the highest quality produ...

Established in 2003 by G. Chandra Mouliswar Reddy, Virupaksha strives to supply the highest quality products to its customers. In less than two decades, the Hyderabad-headquartered company has expanded from a single manufacturing unit to four units employing over 900 employees. Virupaksha’s four manufacturing units are located at Kazipally, Pashamylaram, Humnabad and Gandhi Nagar. Its manufacturing facility is FDA-approved. It now has a large customer base of over 300 customers and a presence in more than 100 countries.

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Shenzhen Haorui

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China

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(S)-2-chloro-1-(2,4-dichlorophenyl)ethanol

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CAS Number

126534-31-4

End Use API

Luliconazole

About the Company

Haorui, established in 1997, is a manufacturer and supplier of APIs, intermediates, veterinary and food a...

Haorui, established in 1997, is a manufacturer and supplier of APIs, intermediates, veterinary and food additives. Meanwhile, it is assisting global pharmaceutical companies to get the domestic registration of their finished dosage for their international expansion. Our USFDA approved products Flumazenil, Granisetron HCl, Granisetron Base, Docetaxel Anhydrous, Irinotecan HCl, Dasatinib Monohydrate, Oxaliplatin and Temozolomide have been recognized by our customers globally. In addition, our Amisulpride API acquired CEP, UK GMP & USDMF.

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