3-Fluoro-4-methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid

CAS Registry Number®

951888-91-8

CAS Name

3-Fluoro-4-methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid

Molecular Formula

C13H15FO4

Molecular Mass

254.25

Cite this Page

3-Fluoro-4-methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=951888-91-8 (retrieved 2024-10-07) (CAS RN: 951888-91-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15FO4/c1-13(2,12(16)17)7-10(15)8-4-5-11(18-3)9(14)6-8/h4-6H,7H2,1-3H3,(H,16,17)

InChIKey

InChIKey=IHJGTSAVLOJSPM-UHFFFAOYSA-N

SMILES

C(CC(C(O)=O)(C)C)(=O)C1=CC(F)=C(OC)C=C1

Canonical SMILES

O=C(O)C(C)(C)CC(=O)C1=CC=C(OC)C(F)=C1

Other Names for this Substance

  • Benzenebutanoic acid, 3-fluoro-4-methoxy-α,α-dimethyl-γ-oxo-
  • 3-Fluoro-4-methoxy-α,α-dimethyl-γ-oxobenzenebutanoic acid

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