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CAS 126534-31-4 manufacturers and suppliers on PharmaCompass

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CAS 126534-31-4
Also known as: 126534-31-4, (1s)-2-chloro-1-(2,4-dichlorophenyl)ethanol, (s)-alpha-(chloromethyl)-2,4-dichlorobenzyl alcohol, Benzenemethanol, 2,4-dichloro-alpha-(chloromethyl)-, (alphas)-, Mfcd07776655, (1s)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol
Molecular Formula
C8H7Cl3O
Molecular Weight
225.5  g/mol
InChI Key
XHEPANNURIQWRM-MRVPVSSYSA-N

1 2D Structure

CAS 126534-31-4

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(1S)-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-/m1/s1
2.1.3 InChI Key
XHEPANNURIQWRM-MRVPVSSYSA-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 Depositor-Supplied Synonyms

1. 126534-31-4

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

3. (s)-alpha-(chloromethyl)-2,4-dichlorobenzyl Alcohol

4. Benzenemethanol, 2,4-dichloro-alpha-(chloromethyl)-, (alphas)-

5. Mfcd07776655

6. (1s)-2-chloro-1-(2,4-dichlorophenyl)ethan-1-ol

7. (s)-2,4-dichloro-alpha-(chloromethyl)-benzenemethanol

8. Schembl6212874

9. Amy38716

10. Bfa53431

11. Zinc2140830

12. Bs-14861

13. Db-097333

14. D5115

15. En300-87665

16. (s)-2-chloro-(2',4'-dichlorophenyl)-1-ethanol

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

18. (s)-2,4-dichloro-a-(chloromethyl)-benzenemethanol

19. (s)-alpha-(chloromethyl)-2,4-dichlorobenzylalcohol

20. (s)-2,4-dichloro-+/--(chloromethyl)benzyl Alcohol

21. (s)-alpha-(chloromethyl)-2,4-dichlorobenzenemethanol

22. (s)-2,4-dichloro-f Inverted Question Mark-(chloromethyl)benzyl Alcohol

2.3 Create Date
2006-01-25
3 Chemical and Physical Properties
Molecular Weight 225.5 g/mol
Molecular Formula C8H7Cl3O
XLogP32.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass223.956248 g/mol
Monoisotopic Mass223.956248 g/mol
Topological Polar Surface Area20.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity142
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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Digital Content Digital Content
URL Supplier Web Content
126534-31-4
Luliconazole
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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