Dihydrokainic acid

CAS Registry Number®

52497-36-6

CAS Name

Dihydrokainic acid

Molecular Formula

C10H17NO4

Molecular Mass

215.25

Cite this Page

Dihydrokainic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=52497-36-6 (retrieved 2024-11-25) (CAS RN: 52497-36-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    285 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H17NO4/c1-5(2)7-4-11-9(10(14)15)6(7)3-8(12)13/h5-7,9,11H,3-4H2,1-2H3,(H,12,13)(H,14,15)/t6-,7+,9-/m0/s1

InChIKey

InChIKey=JQPDCKOQOOQUSC-OOZYFLPDSA-N

SMILES

C(C(O)=O)[C@H]1[C@@H]([C@H](C)C)CN[C@@H]1C(O)=O

Canonical SMILES

O=C(O)CC1C(NCC1C(C)C)C(=O)O

Other Names for this Substance

  • 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethyl)-, (2S,3S,4R)-
  • 3-Pyrrolidineacetic acid, 2-carboxy-4-(1-methylethyl)-, [2S-(2α,3β,4β)]-
  • (2S,3S,4R)-2-Carboxy-4-(1-methylethyl)-3-pyrrolidineacetic acid
  • Dihydrokainic acid
  • α-Dihydrokainic acid

Deleted or Replaced CAS Registry Numbers

59905-20-3

CAS INSIGHTSTM
Hourglass and a clock