CAS 6485-67-2

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Also known as: 6485-67-2, (r)-2-amino-2-phenylacetamide, D(-)-phenylglycinamide, D-phenylglycinamide, (2r)-2-amino-2-phenylethanamide, 2ndy0ko51e

Molecular Formula

C₈H₁₀N₂O

Molecular Weight

150.18 g/mol

InChI Key

KIYRSYYOVDHSPG-SSDOTTSWSA-N

FDA UNII

2NDY0KO51E

1 2D Structure

CAS 6485-67-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2R)-2-amino-2-phenylacetamide

2.1.2 InChI

InChI=1S/C8H10N2O/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H2,10,11)/t7-/m1/s1

2.1.3 InChI Key

KIYRSYYOVDHSPG-SSDOTTSWSA-N

2.1.4 Canonical SMILES

C1=CC=C(C=C1)C(C(=O)N)N

2.1.5 Isomeric SMILES

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

2.2 Other Identifiers

2.2.1 UNII

2NDY0KO51E

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 6485-67-2

2. (r)-2-amino-2-phenylacetamide

3. D(-)-phenylglycinamide

4. D-phenylglycinamide

5. (2r)-2-amino-2-phenylethanamide

6. 2ndy0ko51e

7. D-phenylglycine Amide

8. Unii-2ndy0ko51e

9. Mfcd06799064

10. Ec 420-370-0

11. D-(-)-phenylglycine Amide

12. Schembl2332933

13. Dtxsid30215140

14. D(-)-phenylglycinamide, Aldrichcpr

15. Benzeneacetamide, A-amino-, (ar)-

16. Zinc19810012

17. Akos016842344

18. Cs-w019313

19. Gs-3126

20. Bp-12536

21. O10163

22. 485p672

23. A834906

24. Q27255108

25. [(1r)-2-amino-2-oxo-1-phenyl-ethyl]ammonium;(r)-2-amino-2-phenylacetamide

2.4 Create Date

2005-07-08

3 Chemical and Physical Properties

Molecular Formula	C₈H₁₀N₂O
Molecular Weight	150.18 g/mol
XLogP3	-0.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	150.079312947 g/mol
Monoisotopic Mass	150.079312947 g/mol
Topological Polar Surface Area	69.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	141
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