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CAS 141109-14-0
Also known as: 141109-14-0, (s)-methyl 2-amino-2-(2-chlorophenyl)acetate, L-2-chlorophenylglycine methyl ester, Methyl (2s)-2-amino-2-(2-chlorophenyl)acetate, (s)-2-chlorophenylglycine methyl ester, Methyl (2s)-amino(2-chlorophenyl)acetate
Molecular Formula
C9H10ClNO2
Molecular Weight
199.63  g/mol
InChI Key
UTWOZNRDJNWTPS-QMMMGPOBSA-N

1 2D Structure

CAS 141109-14-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl (2S)-2-amino-2-(2-chlorophenyl)acetate
2.1.2 InChI
InChI=1S/C9H10ClNO2/c1-13-9(12)8(11)6-4-2-3-5-7(6)10/h2-5,8H,11H2,1H3/t8-/m0/s1
2.1.3 InChI Key
UTWOZNRDJNWTPS-QMMMGPOBSA-N
2.1.4 Canonical SMILES
COC(=O)C(C1=CC=CC=C1Cl)N
2.1.5 Isomeric SMILES
COC(=O)[C@H](C1=CC=CC=C1Cl)N
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 141109-14-0

2. (s)-methyl 2-amino-2-(2-chlorophenyl)acetate

3. L-2-chlorophenylglycine Methyl Ester

4. Methyl (2s)-2-amino-2-(2-chlorophenyl)acetate

5. (s)-2-chlorophenylglycine Methyl Ester

6. Methyl (2s)-amino(2-chlorophenyl)acetate

7. Schembl5101666

8. Dtxsid10471702

9. Ac-255

10. Mfcd02258899

11. Zinc21983015

12. Akos016842506

13. Am84375

14. Cs-0107172

15. L-(+)-(2-chlorophenyl)glycine Methyl Ester

16. (s)-methyl2-amino-2-(2-chlorophenyl)acetate

17. D97832

18. Methyl (s)-2-amino-2-(2-chlorophenyl)acetate

19. (s)-amino(2-chlorophenyl)acetic Acid Methyl Ester

20. 109c140

21. Q-101328

22. (+)2-(2-chlorophenyl)glycine Methyl Ester (tartrate Salt)

23. Methyl (+)-(s)-alpha-amino-alpha-(2-chlorophenyl)acetate

24. Benzeneacetic Acid, Alpha-amino-2-chloro-, Methyl Ester, (alphas)-

2.3 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 199.63 g/mol
Molecular Formula C9H10ClNO2
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass199.0400063 g/mol
Monoisotopic Mass199.0400063 g/mol
Topological Polar Surface Area52.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity187
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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VASUDHA PHARMA CHEM LIMITED was incorporated, as a public limited company under the Companies Act, 1956 in 1994-95 at Hyderabad in the state of Telangana, India. The company is engaged in the manufacturing of Active Pharmaceutical Ingredients (APIs), Pharma Intermediates for catering to the Global market. Initially, the focus was on the development of cost effective processes for several intermediates related to piperidone & piperidine derivatives. By 2003-04, the company gained world class expertise and became the largest manufacturer of piperidone & piperidine derivatives in the world.
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