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beta-Methylbenzenebutyric Acid
[CAS# 7315-68-6]

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Identification
Name beta-Methylbenzenebutyric Acid
Synonyms 3-Methyl-4-Phenyl-Butanoic Acid; 3-Methyl-4-Phenyl-Butyric Acid; Benzenebutanoic Acid, .Beta.-Methyl-
Molecular Structure CAS#: 7315-68-6, beta-Methylbenzenebutyric Acid
Molecular Formula C11H14O2
Molecular Weight 178.23
CAS Registry Number 7315-68-6
SMILES C1=CC=C(C=C1)CC(C)CC(=O)O
InChI 1S/C11H14O2/c1-9(8-11(12)13)7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,12,13)
InChIKey CJBVVZBGGFKPDA-UHFFFAOYSA-N
Properties
Density 1.069g/cm3 (Cal.)
Boiling point 298.267°C at 760 mmHg (Cal.)
Flash point 195.395°C (Cal.)
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