Methyl 4-(1-oxopentyl)benzoate
CAS Registry Number®
30611-21-3
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CAS Name
Methyl 4-(1-oxopentyl)benzoateMolecular Formula
C13H16O3Molecular Mass
220.26Cite this Page
Methyl 4-(1-oxopentyl)benzoate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=30611-21-3 (retrieved ) (CAS RN: 30611-21-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
40-43 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H16O3/c1-3-4-5-12(14)10-6-8-11(9-7-10)13(15)16-2/h6-9H,3-5H2,1-2H3
InChIKey
InChIKey=LSDGSJYZSOPREL-UHFFFAOYSA-N
SMILES
C(CCCC)(=O)C1=CC=C(C(OC)=O)C=C1
Canonical SMILES
O=C(OC)C1=CC=C(C=C1)C(=O)CCCC
Other Names for this Substance
- Benzoic acid, 4-(1-oxopentyl)-, methyl ester
- Benzoic acid, p-valeryl-, methyl ester
- Methyl 4-(1-oxopentyl)benzoate