β-[(2,2,2-Trifluoroacetyl)amino]-1,3-benzodioxole-5-propanoic acid

CAS Registry Number®

174502-41-1
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CAS Name

β-[(2,2,2-Trifluoroacetyl)amino]-1,3-benzodioxole-5-propanoic acid

Molecular Formula

C12H10F3NO5

Molecular Mass

305.21

Cite this Page

β-[(2,2,2-Trifluoroacetyl)amino]-1,3-benzodioxole-5-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=174502-41-1 (retrieved 2024-08-30) (CAS RN: 174502-41-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H10F3NO5/c13-12(14,15)11(19)16-7(4-10(17)18)6-1-2-8-9(3-6)21-5-20-8/h1-3,7H,4-5H2,(H,16,19)(H,17,18)

InChIKey

InChIKey=ARJWVNQRHKKYMF-UHFFFAOYSA-N

SMILES

C(NC(C(F)(F)F)=O)(CC(O)=O)C=1C=C2C(=CC1)OCO2

Canonical SMILES

O=C(O)CC(NC(=O)C(F)(F)F)C1=CC=C2OCOC2=C1

Other Names for this Substance

  • 1,3-Benzodioxole-5-propanoic acid, β-[(2,2,2-trifluoroacetyl)amino]-
  • 1,3-Benzodioxole-5-propanoic acid, β-[(trifluoroacetyl)amino]-
  • β-[(2,2,2-Trifluoroacetyl)amino]-1,3-benzodioxole-5-propanoic acid