Hexahydro-2-oxo-1H-azepine-3-acetic acid

CAS Registry Number®

827-67-8
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CAS Name

Hexahydro-2-oxo-1H-azepine-3-acetic acid

Molecular Formula

C8H13NO3

Molecular Mass

171.19

Cite this Page

Hexahydro-2-oxo-1H-azepine-3-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=827-67-8 (retrieved 2024-08-14) (CAS RN: 827-67-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    176-177 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H13NO3/c10-7(11)5-6-3-1-2-4-9-8(6)12/h6H,1-5H2,(H,9,12)(H,10,11)

InChIKey

InChIKey=KDKKRNOYSMNNJF-UHFFFAOYSA-N

SMILES

C(C(O)=O)C1C(=O)NCCCC1

Canonical SMILES

O=C(O)CC1C(=O)NCCCC1

Other Names for this Substance

  • 1H-Azepine-3-acetic acid, hexahydro-2-oxo-
  • Azepine-3-acetic acid, hexahydro-2-oxo-
  • Hexahydro-2-oxo-1H-azepine-3-acetic acid
  • 2-(2-Oxoazepan-3-yl)acetic acid