3-Bromo-4-pentylbenzoic acid
CAS Registry Number®
1131615-13-8
CAS Name
3-Bromo-4-pentylbenzoic acidMolecular Formula
C12H15BrO2Molecular Mass
271.15Cite this Page
3-Bromo-4-pentylbenzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1131615-13-8 (retrieved ) (CAS RN: 1131615-13-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H15BrO2/c1-2-3-4-5-9-6-7-10(12(14)15)8-11(9)13/h6-8H,2-5H2,1H3,(H,14,15)
InChIKey
InChIKey=MQFNWGDNZJKUFZ-UHFFFAOYSA-N
SMILES
C(CCCC)C1=C(Br)C=C(C(O)=O)C=C1
Canonical SMILES
O=C(O)C1=CC=C(C(Br)=C1)CCCCC
Other Names for this Substance
- Benzoic acid, 3-bromo-4-pentyl-
- 3-Bromo-4-pentylbenzoic acid