4-Hexylbenzoic acid
CAS Registry Number®
21643-38-9
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CAS Name
4-Hexylbenzoic acidMolecular Formula
C13H18O2Molecular Mass
206.28Cite this Page
4-Hexylbenzoic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=21643-38-9 (retrieved ) (CAS RN: 21643-38-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
97 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H18O2/c1-2-3-4-5-6-11-7-9-12(10-8-11)13(14)15/h7-10H,2-6H2,1H3,(H,14,15)
InChIKey
InChIKey=CPEPWESLFZVUEP-UHFFFAOYSA-N
SMILES
C(O)(=O)C1=CC=C(CCCCCC)C=C1
Canonical SMILES
O=C(O)C1=CC=C(C=C1)CCCCCC
Other Names for this Substance
- Benzoic acid, 4-hexyl-
- Benzoic acid, p-hexyl-
- 4-Hexylbenzoic acid
- p-Hexylbenzoic acid
- 4-n-Hexylbenzoic acid
