2-Bromo-ε-oxobenzenehexanoic acid
CAS Registry Number®
898765-24-7
CAS Name
2-Bromo-ε-oxobenzenehexanoic acidMolecular Formula
C12H13BrO3Molecular Mass
285.13Cite this Page
2-Bromo-ε-oxobenzenehexanoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=898765-24-7 (retrieved ) (CAS RN: 898765-24-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H13BrO3/c13-10-6-2-1-5-9(10)11(14)7-3-4-8-12(15)16/h1-2,5-6H,3-4,7-8H2,(H,15,16)
InChIKey
InChIKey=WRCSHBODFJNDGG-UHFFFAOYSA-N
SMILES
C(CCCCC(O)=O)(=O)C1=C(Br)C=CC=C1
Canonical SMILES
O=C(O)CCCCC(=O)C=1C=CC=CC1Br
Other Names for this Substance
- Benzenehexanoic acid, 2-bromo-ε-oxo-
- 2-Bromo-ε-oxobenzenehexanoic acid