N-(6-Chloro-4-pyrimidinyl)-β-alanine

CAS Registry Number®

1379331-13-1
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CAS Name

N-(6-Chloro-4-pyrimidinyl)-β-alanine

Molecular Formula

C7H8ClN3O2

Molecular Mass

201.61

Cite this Page

N-(6-Chloro-4-pyrimidinyl)-β-alanine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1379331-13-1 (retrieved 2024-08-06) (CAS RN: 1379331-13-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C7H8ClN3O2/c8-5-3-6(11-4-10-5)9-2-1-7(12)13/h3-4H,1-2H2,(H,12,13)(H,9,10,11)

InChIKey

InChIKey=WHAOQUGBWGHNIO-UHFFFAOYSA-N

SMILES

N(CCC(O)=O)C=1C=C(Cl)N=CN1

Canonical SMILES

O=C(O)CCNC=1N=CN=C(Cl)C1

Other Names for this Substance

  • β-Alanine, N-(6-chloro-4-pyrimidinyl)-
  • N-(6-Chloro-4-pyrimidinyl)-β-alanine