ChemSpider 2D Image | (2R)-2-Ethylhexyl (2E)-2-cyano-3-(4-methoxyphenyl)-3-phenylacrylate | C25H29NO3

(2R)-2-Ethylhexyl (2E)-2-cyano-3-(4-methoxyphenyl)-3-phenylacrylate

  • Molecular FormulaC25H29NO3
  • Average mass391.503 Da
  • Monoisotopic mass391.214752 Da
  • ChemSpider ID34993888

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2E)-2-Cyano-3-(4-méthoxyphényl)-3-phénylacrylate de (2R)-2-éthylhexyle [French] [ACD/IUPAC Name]
(2R)-2-Ethylhexyl (2E)-2-cyano-3-(4-methoxyphenyl)-3-phenylacrylate [ACD/IUPAC Name]
(2R)-2-Ethylhexyl-(2E)-2-cyan-3-(4-methoxyphenyl)-3-phenylacrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 2-cyano-3-(4-methoxyphenyl)-3-phenyl-, (2R)-2-ethylhexyl ester, (2E)- [ACD/Index Name]
947753-66-4 [RN]
ETHYLHEXYL METHOXYCRYLENE
UNII-S3KFG6Q5X8

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 517.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 223.9±20.3 °C
Index of Refraction: 1.540
Molar Refractivity: 115.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.47
ACD/LogD (pH 5.5): 6.60
ACD/BCF (pH 5.5): 60842.94
ACD/KOC (pH 5.5): 92495.12
ACD/LogD (pH 7.4): 6.60
ACD/BCF (pH 7.4): 60842.94
ACD/KOC (pH 7.4): 92495.12
Polar Surface Area: 59 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 366.5±3.0 cm3

Click to predict properties on the Chemicalize site


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