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10031-93-3

Basic Information
CAS No.: 10031-93-3
Name: Benzenebutanoic acid,ethyl ester
Molecular Structure:
Molecular Structure of 10031-93-3 (Benzenebutanoic acid,ethyl ester)
Formula: C12H16 O2
Molecular Weight: 192.25
Synonyms: Butyricacid, 4-phenyl-, ethyl ester (6CI,8CI); Ethyl 4-phenylbutanoate; Ethyl4-phenylbutyrate; NSC 163318
EINECS:
Density: 1.002g/cm3
Melting Point:
Boiling Point: 276.6°Cat760mmHg
Flash Point: 114.4°C
Solubility:
Appearance:
Hazard Symbols:
Risk Codes:
Safety:
Transport Information:
PSA: 26.30000
LogP: 2.57240
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Chemistry

Molecular Structure of Ethyl 4-phenylbutyrate (CAS No.10031-93-3):
 
Molecular Formula: C12H16O2 
Molecular Weight: 192.2542
CAS No: 10031-93-3
IUPAC Name: Ethyl 4-phenylbutanoate 
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 6
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.496
Molar Refractivity: 56.1 cm3
Molar Volume: 191.7 cm3
Surface Tension: 35.3 dyne/cm
Density: 1.002 g/cm3
Flash Point: 114.4 °C
Enthalpy of Vaporization: 51.51 kJ/mol
Boiling Point: 276.6 °C at 760 mmHg
Vapour Pressure: 0.00476 mmHg at 25°C
InChI: InChI=1/C12H16O2/c1-2-14-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
InChIKey: GGFNXKFGVQQNRV-UHFFFAOYAZ
Std. InChI: InChI=1S/C12H16O2/c1-2-14-12(13)10-6-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3
Std. InChIKey: GGFNXKFGVQQNRV-UHFFFAOYSA-N

Specification

   Ethyl 4-phenylbutyrate (CAS No.10031-93-3), its synonyms are Benzenebutanoic acid, ethyl ester ; Butyric acid, 4-phenyl-, ethyl ester ; Ethyl 4-phenylbutanoate ; Ethyl benzenebutanoate ; Ethyl gamma-phenylbutyrate .