4-[[(3-Carboxy-1-oxo-2-propen-1-yl)amino]methyl]cyclohexanecarboxylic acid

CAS Registry Number®

72748-87-9
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CAS Name

4-[[(3-Carboxy-1-oxo-2-propen-1-yl)amino]methyl]cyclohexanecarboxylic acid

Molecular Formula

C12H17NO5

Molecular Mass

255.27

Cite this Page

4-[[(3-Carboxy-1-oxo-2-propen-1-yl)amino]methyl]cyclohexanecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=72748-87-9 (retrieved 2024-09-07) (CAS RN: 72748-87-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    201 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H17NO5/c14-10(5-6-11(15)16)13-7-8-1-3-9(4-2-8)12(17)18/h5-6,8-9H,1-4,7H2,(H,13,14)(H,15,16)(H,17,18)

InChIKey

InChIKey=XFEDBGCHJRFAAA-UHFFFAOYSA-N

SMILES

C(NC(C=CC(O)=O)=O)C1CCC(C(O)=O)CC1

Canonical SMILES

O=C(O)C=CC(=O)NCC1CCC(C(=O)O)CC1

Other Names for this Substance

  • Cyclohexanecarboxylic acid, 4-[[(3-carboxy-1-oxo-2-propen-1-yl)amino]methyl]-
  • Cyclohexanecarboxylic acid, 4-[[(3-carboxy-1-oxo-2-propenyl)amino]methyl]-
  • 4-[[(3-Carboxy-1-oxo-2-propen-1-yl)amino]methyl]cyclohexanecarboxylic acid

Deleted or Replaced CAS Registry Numbers

80124-90-9