CAS Registry Number®
122-67-8
CAS Name
Isobutyl cinnamate
Molecular Formula
C13H16O2
Molecular Mass
204.26
Compound Properties
-
Boiling Point (1)
154 °C @ Press: 12 Torr
-
Density (1)
1.0170 g/cm³ @ Temp: 20 °C
Source(s)
- (1) Derbentseva, N. A.; Izvest. Akad. Nauk Beloruss. S.S.R., (1948), (No. 2), 114-24, CAplus
Other Names and Identifiers
InChI
InChI=1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3
InChIKey
InChIKey=IQZUZPKOFSOVET-UHFFFAOYSA-N
SMILES
C(=CC(OCC(C)C)=O)C1=CC=CC=C1
Canonical SMILES
O=C(OCC(C)C)C=CC=1C=CC=CC1
Other Names for this Substance
- 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester
- Cinnamic acid, isobutyl ester
- Labdanol
- Isobutyl cinnamate
- NSC 404181
