Isoamyl benzoate
CAS Registry Number®
94-46-2
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CAS Name
Isoamyl benzoateMolecular Formula
C12H16O2Molecular Mass
192.25Cite this Page
Isoamyl benzoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=94-46-2 (retrieved ) (CAS RN: 94-46-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
261 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C12H16O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3
InChIKey
InChIKey=MLLAPOCBLWUFAP-UHFFFAOYSA-N
SMILES
C(OCCC(C)C)(=O)C1=CC=CC=C1
Canonical SMILES
O=C(OCCC(C)C)C=1C=CC=CC1
Other Names for this Substance
- 1-Butanol, 3-methyl-, 1-benzoate
- Isopentyl alcohol, benzoate
- 1-Butanol, 3-methyl-, benzoate
- iso-Amyl benzoate
- Isopentyl benzoate
