19883-41-1

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2 Suppliers, 2 End Use APIs, 5 Related Intermediates

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2 End Use APIs
5 Related Intermediates

Chemistry

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Also known as: 19883-41-1, H-d-phg-ome hcl, (r)-2-phenylglycine methyl ester hydrochloride, (r)-(-)-2-phenylglycine methyl ester hydrochloride, Methyl (2r)-2-amino-2-phenylacetate hydrochloride, Methyl (2r)-2-amino-2-phenylacetate;hydrochloride

Molecular Formula

C₉H₁₂ClNO₂

Molecular Weight

201.65 g/mol

InChI Key

DTHMTBUWTGVEFG-DDWIOCJRSA-N

1 2D Structure

19883-41-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

methyl (2R)-2-amino-2-phenylacetate;hydrochloride

2.1.2 InChI

InChI=1S/C9H11NO2.ClH/c1-12-9(11)8(10)7-5-3-2-4-6-7;/h2-6,8H,10H2,1H3;1H/t8-;/m1./s1

2.1.3 InChI Key

DTHMTBUWTGVEFG-DDWIOCJRSA-N

2.1.4 Canonical SMILES

COC(=O)C(C1=CC=CC=C1)N.Cl

2.1.5 Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)N.Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 19883-41-1

2. H-d-phg-ome Hcl

3. (r)-2-phenylglycine Methyl Ester Hydrochloride

4. (r)-(-)-2-phenylglycine Methyl Ester Hydrochloride

5. Methyl (2r)-2-amino-2-phenylacetate Hydrochloride

6. Methyl (2r)-2-amino-2-phenylacetate;hydrochloride

7. Mfcd00137487

8. D-alpha-phenylglycine Methyl Ester Hydrochloride

9. D-(-)-2-phenylglycine Methyl Ester Hydrochloride

10. Methyl (r)-2-amino-2-phenylacetate Hydrochloride

11. [(1r)-2-methoxy-2-oxo-1-phenylethyl]azanium;chloride

12. D-

13. A-phenylglycine Methyl Ester Hydrochloride

14. H-d-phg-ome Hydrochloride

15. Methyl (2r)-amino(phenyl)acetate Hydrochloride

16. Schembl1143309

17. Dthmtbuwtgvefg-ddwiocjrsa-n

18. Akos015846308

19. Akos015903224

20. Cs-w015540

21. Hy-w014824

22. Sy020988

23. (r)-2-phenylglycinemethylesterhydrochloride

24. (r)-2-phenylglycine Methyl Ester Hcl

25. Am20060537

26. P2592

27. E70004

28. En300-657365

29. W-107665

30. (r)-methyl 2-amino-2-phenylacetate, Hydrochloride Salt

31. Methyl (r)-(-)-2-amino-2-phenylacetate Hydrochloride

32. (r)-(-)-2-phenylglycine Methyl Ester Hydrochloride, >=95%

33. (r)-(-)-2-amino-2-phenylacetic Acid Methyl Ester Hydrochloride

34. Benzeneacetic Acid, A-amino-, Methyl Ester, Hydrochloride, (ar)-

2.3 Create Date

2007-02-07

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₂ClNO₂
Molecular Weight	201.65 g/mol
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	52.3
Heavy Atom Count	13
Formal Charge	0
Complexity	153
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	2