Basic information
- Name:
2-Propenoic acid,3-phenyl-, 3-methylbutyl ester
- Superlist Name:
- Isoamyl cinnamate
- CAS No.:
7779-65-9
- Molecular Structure:
- Formula:
- C14H18O2
- Molecular Weight:
- 218.29
- Synonyms:
- Cinnamicacid, isopentyl ester (8CI);Isopentyl alcohol, cinnamate (8CI);
- EINECS:
- 231-931-2
- Density:
- 0.995 g/cm3
- Boiling Point:
- 310 °C
- Flash Point:
- >110 °C
- Solubility:
- <0.1 g/100 mL at 20 °C in water
- Appearance:
- pale yellow liquid
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Chemistry
Molecule structure of Isoamyl cinnamate (CAS NO.7779-65-9):
Systematic Name: Isopentyl (Z)-3-phenylprop-2-enoate
Molecular Formula: C14H18O2
Molecular Weight: 218.29 g/mol
CAS Registry Number: 7779-65-9
Index of Refraction: 1.53
Molar Refractivity: 67.04 cm3
Molar Volume: 216.8 cm3
Surface Tension: 36 dyne/cm
Density: 1.006 g/cm3
Flash Point: 165.2 °C
Enthalpy of Vaporization: 55.42 kJ/mol
Boiling Point: 313.2 °C at 760 mmHg
Vapour Pressure: 0.000505 mmHg at 25 °C
FEMA: 2063
Water Solubility: <0.1 g/100 mL at 20 °C
Stability: stability combustible. incompatible with strong oxidizing agents.
SMILES: CC(C)CCOC(=O)C=Cc1ccccc1
InChI: InChI=1/C14H18O2/c1-12(2)10-11-16-14(15)9-8-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3/b9-8-
InChIKey: JFHCDEYLWGVZMX-HJWRWDBZBU
Std. InChI: InChI=1S/C14H18O2/c1-12(2)10-11-16-14(15)9-8-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3/b9-8-
Std. InChIKey: JFHCDEYLWGVZMX-HJWRWDBZSA-N
EINECS: 231-931-2
Specification
Isoamyl cinnamate (CAS NO.7779-65-9) is also named as 2-Propenoic acid, 3-phenyl-, 3-methylbutyl ester ; 3-Methylbutyl 3-phenyl-2-propenoate ; Isopentyl 3-phenyl propenoate . Isoamyl cinnamate (CAS NO.7779-65-9) is pale yellow liquid with an iridescent sheen. It is insoluble in water. It is an ester. Esters react with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction of esters with caustic solutions. Flammable hydrogen is generated by mixing esters with alkali metals and hydrides. Isoamyl cinnamate is probably combustible.