N-(4-Nitrophenyl)-β-alanine

CAS Registry Number®

35005-61-9

CAS Name

N-(4-Nitrophenyl)-β-alanine

Molecular Formula

C9H10N2O4

Molecular Mass

210.19

Cite this Page

N-(4-Nitrophenyl)-β-alanine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35005-61-9 (retrieved 2024-11-21) (CAS RN: 35005-61-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    156-157.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H10N2O4/c12-9(13)5-6-10-7-1-3-8(4-2-7)11(14)15/h1-4,10H,5-6H2,(H,12,13)

InChIKey

InChIKey=CKMRSZAIJYEUKL-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CCNC1=CC=C(C=C1)N(=O)=O

Other Names for this Substance

  • β-Alanine, N-(4-nitrophenyl)-
  • N-(4-Nitrophenyl)-β-alanine
  • 3-(p-Nitroanilino)propionic acid
  • 3-[(4-Nitrophenyl)amino]propanoic acid

CAS INSIGHTSTM
Targeted protein degrader structure, illustration