N-(Phenylmethyl)-β-alanine ethyl ester

CAS Registry Number®

23583-21-3

CAS Name

N-(Phenylmethyl)-β-alanine ethyl ester

Molecular Formula

C12H17NO2

Molecular Mass

207.27

Cite this Page

N-(Phenylmethyl)-β-alanine ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23583-21-3 (retrieved 2024-11-22) (CAS RN: 23583-21-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    132-134 °C @ Press: 2 Torr

  • Density (1)

    1.9126 g/cm³ @ Temp: 20 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H17NO2/c1-2-15-12(14)8-9-13-10-11-6-4-3-5-7-11/h3-7,13H,2,8-10H2,1H3

InChIKey

InChIKey=HCTJHQFFNDLDPF-UHFFFAOYSA-N

SMILES

C(NCCC(OCC)=O)C1=CC=CC=C1

Canonical SMILES

O=C(OCC)CCNCC=1C=CC=CC1

Other Names for this Substance

  • β-Alanine, N-(phenylmethyl)-, ethyl ester
  • β-Alanine, N-benzyl-, ethyl ester
  • N-(Phenylmethyl)-β-alanine ethyl ester
  • Ethyl 3-(benzylamino)propionate
  • Ethyl N-benzyl-β-alaninate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration