Pregabalin Impurity III

CAS:181289-33-8

SKU: NCC.181289.33.8 分类:
保证安全结账

CAS Registry Number®

181289-33-8

CAS Name

(R)-3-(Carbamoylmethyl)-5-methylhexanoic acid

Molecular Formula

C9H17NO3

Molecular Mass

187.24

Compound Properties

  • Melting Point (1)

    131-135 °C

Source(s)

  • (1) Jung, Jae-Hoon; Organic & Biomolecular Chemistry, (2013), 11(22), 3635-3641, CAplus

Other Names and Identifiers

InChI

InChI=1S/C9H17NO3/c1-6(2)3-7(4-8(10)11)5-9(12)13/h6-7H,3-5H2,1-2H3,(H2,10,11)(H,12,13)/t7-/m1/s1

InChIKey

InChIKey=NPDKTSLVWGFPQG-SSDOTTSWSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Hexanoic acid, 3-(2-amino-2-oxoethyl)-5-methyl-, (3R)-
  • Hexanoic acid, 3-(2-amino-2-oxoethyl)-5-methyl-, (R)-
  • (3R)-3-(2-Amino-2-oxoethyl)-5-methylhexanoic acid
  • (R)-3-(Carbamoylmethyl)-5-methylhexanoic acid
  • (R)-(-)-3-(Carbamoylmethyl)-5-methylhexanoic acid
  • (R)-3-(2-Amino-2-oxoethyl)-5-methylhexanoic acid
  • (3R)-3-(2-Amino-2-oxoethyl)-5-methylhexanoic acid
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