(+)-3-Phenylbutyric acid
CAS Registry Number®
772-15-6
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CAS Name
(+)-3-Phenylbutyric acidMolecular Formula
C10H12O2Molecular Mass
164.20Cite this Page
(+)-3-Phenylbutyric acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=772-15-6 (retrieved ) (CAS RN: 772-15-6). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
113-115 °C @ Press: 3 Torr
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)/t8-/m0/s1
InChIKey
InChIKey=ZZEWMYILWXCRHZ-QMMMGPOBSA-N
SMILES
[C@@H](CC(O)=O)(C)C1=CC=CC=C1
Canonical SMILES
O=C(O)CC(C=1C=CC=CC1)C
Other Names for this Substance
- Benzenepropanoic acid, β-methyl-, (βS)-
- Hydrocinnamic acid, β-methyl-, (S)-
- Benzenepropanoic acid, β-methyl-, (S)-
- (βS)-β-Methylbenzenepropanoic acid
- (S)-(+)-β-Methylhydrocinnamic acid
