Benzoic acid, 4-methoxy-, 3-methylbutyl ester
CAS Registry Number®
27739-29-3
CAS Name
Benzoic acid, 4-methoxy-, 3-methylbutyl esterMolecular Formula
C13H18O3Molecular Mass
222.28Cite this Page
Benzoic acid, 4-methoxy-, 3-methylbutyl ester. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=27739-29-3 (retrieved ) (CAS RN: 27739-29-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
188 °C @ Press: 30 TorrDensity (1)
1.040 g/cm³ @ Temp: 16.5 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C13H18O3/c1-10(2)8-9-16-13(14)11-4-6-12(15-3)7-5-11/h4-7,10H,8-9H2,1-3H3
InChIKey
InChIKey=FVMBSMBXEVMMGH-UHFFFAOYSA-N
SMILES
C(OCCC(C)C)(=O)C1=CC=C(OC)C=C1
Canonical SMILES
O=C(OCCC(C)C)C1=CC=C(OC)C=C1
Other Names for this Substance
- Benzoic acid, 4-methoxy-, 3-methylbutyl ester
- p-Anisic acid, isopentyl ester
- Isopentyl alcohol, p-anisate
- 3-Methylbutyl 4-methoxybenzoate
- Isopentyl 4-methoxybenzoate