3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride (1:1), (1R,2S)-rel-

CAS Registry Number®

27107-79-5
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CAS Name

3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride (1:1), (1R,2S)-rel-

Molecular Formula

C17H23NO2.ClH

Cite this Page

3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride (1:1), (1R,2S)-rel-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=27107-79-5 (retrieved 2021-12-01) (CAS RN: 27107-79-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    159 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1/C17H23NO2.ClH/c1-4-20-16(19)17(14-10-6-5-7-11-14)13-9-8-12-15(17)18(2)3;/h5-8,10-12,15H,4,9,13H2,1-3H3;1H/t15-,17+;/s2

InChIKey

InChIKey=MUWDJVKYGSDUSH-WQSQCKSQNA-N

SMILES

C(OCC)(=O)[C@]1([C@H](N(C)C)C=CCC1)C2=CC=CC=C2.Cl

Canonical SMILES

Cl.O=C(OCC)C1(C=2C=CC=CC2)CCC=CC1N(C)C

Other Names for this Substance

  • 3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride (1:1), (1R,2S)-rel-
  • 3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride, trans-(±)-
  • 3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride, trans-
  • 3-Cyclohexene-1-carboxylic acid, 2-(dimethylamino)-1-phenyl-, ethyl ester, hydrochloride, (1R,2S)-rel-
  • Valoron

Deleted or Replaced CAS Registry Numbers

35481-00-6