4-Bromo-2-methyl-ε-oxobenzenehexanoic acid

CAS Registry Number®

898767-34-5
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CAS Name

4-Bromo-2-methyl-ε-oxobenzenehexanoic acid

Molecular Formula

C13H15BrO3

Molecular Mass

299.16

Cite this Page

4-Bromo-2-methyl-ε-oxobenzenehexanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=898767-34-5 (retrieved 2024-08-16) (CAS RN: 898767-34-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15BrO3/c1-9-8-10(14)6-7-11(9)12(15)4-2-3-5-13(16)17/h6-8H,2-5H2,1H3,(H,16,17)

InChIKey

InChIKey=PAWGPSUTOOCDQN-UHFFFAOYSA-N

SMILES

C(CCCCC(O)=O)(=O)C1=C(C)C=C(Br)C=C1

Canonical SMILES

O=C(O)CCCCC(=O)C1=CC=C(Br)C=C1C

Other Names for this Substance

  • Benzenehexanoic acid, 4-bromo-2-methyl-ε-oxo-
  • 4-Bromo-2-methyl-ε-oxobenzenehexanoic acid