Methyl α,α-dimethyl-3,5-bis(trifluoromethyl)benzeneacetate

CAS Registry Number®

334477-48-4

CAS Name

Methyl α,α-dimethyl-3,5-bis(trifluoromethyl)benzeneacetate

Molecular Formula

C13H12F6O2

Molecular Mass

314.22

Cite this Page

Methyl α,α-dimethyl-3,5-bis(trifluoromethyl)benzeneacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=334477-48-4 (retrieved 2024-10-07) (CAS RN: 334477-48-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H12F6O2/c1-11(2,10(20)21-3)7-4-8(12(14,15)16)6-9(5-7)13(17,18)19/h4-6H,1-3H3

InChIKey

InChIKey=JJJDVZYBHXSUMC-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)C(C=1C=C(C=C(C1)C(F)(F)F)C(F)(F)F)(C)C

Other Names for this Substance

  • Benzeneacetic acid, α,α-dimethyl-3,5-bis(trifluoromethyl)-, methyl ester
  • Methyl α,α-dimethyl-3,5-bis(trifluoromethyl)benzeneacetate

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