Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate

CAS Registry Number®

192436-84-3
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CAS Name

Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate

Molecular Formula

C10H17NO2

Molecular Mass

183.25

Cite this Page

Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=192436-84-3 (retrieved 2024-09-06) (CAS RN: 192436-84-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    169-171 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H17NO2/c1-13-10(12)9-6-7-4-2-3-5-8(7)11-9/h7-9,11H,2-6H2,1H3/t7-,8-,9-/m0/s1

InChIKey

InChIKey=OITFEJDUSSGRIH-CIUDSAMLSA-N

SMILES

C(OC)(=O)[C@@H]1C[C@]2([C@@](N1)(CCCC2)[H])[H]

Canonical SMILES

O=C(OC)C1NC2CCCCC2C1

Other Names for this Substance

  • 1H-Indole-2-carboxylic acid, octahydro-, methyl ester, (2S,3aS,7aS)-
  • 1H-Indole-2-carboxylic acid, octahydro-, methyl ester, [2S-(2α,3aβ,7aβ)]-
  • Methyl (2S,3aS,7aS)-octahydro-1H-indole-2-carboxylate

Deleted or Replaced CAS Registry Numbers

1873279-31-2