3-Bromo-4-(1-methylethyl)benzoic acid

CAS Registry Number®

99070-17-4
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CAS Name

3-Bromo-4-(1-methylethyl)benzoic acid

Molecular Formula

C10H11BrO2

Molecular Mass

243.10

Cite this Page

3-Bromo-4-(1-methylethyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=99070-17-4 (retrieved 2024-09-11) (CAS RN: 99070-17-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    151-153 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H11BrO2/c1-6(2)8-4-3-7(10(12)13)5-9(8)11/h3-6H,1-2H3,(H,12,13)

InChIKey

InChIKey=VLOPEDMMJXCNSH-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(Br)=C(C(C)C)C=C1

Canonical SMILES

O=C(O)C1=CC=C(C(Br)=C1)C(C)C

Other Names for this Substance

  • Benzoic acid, 3-bromo-4-(1-methylethyl)-
  • Benzoic acid, 3-bromo-4-isopropyl-
  • Cumic acid, 3-bromo-
  • 3-Bromo-4-(1-methylethyl)benzoic acid
  • 3-Bromo-4-(propan-2-yl)benzoic acid