3,4-Diaminobenzenepropanoic acid

CAS Registry Number®

54405-45-7
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CAS Name

3,4-Diaminobenzenepropanoic acid

Molecular Formula

C9H12N2O2

Molecular Mass

180.20

Cite this Page

3,4-Diaminobenzenepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=54405-45-7 (retrieved 2024-09-16) (CAS RN: 54405-45-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H12N2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5H,2,4,10-11H2,(H,12,13)

InChIKey

InChIKey=BKJRYXYXDRWDBP-UHFFFAOYSA-N

SMILES

C(CC(O)=O)C1=CC(N)=C(N)C=C1

Canonical SMILES

O=C(O)CCC1=CC=C(N)C(N)=C1

Other Names for this Substance

  • Benzenepropanoic acid, 3,4-diamino-
  • 3,4-Diaminobenzenepropanoic acid
  • β-(3,4-Diaminophenyl)propionic acid