ChemSpider 2D Image | 3-dodecenoic acid | C12H22O2

3-dodecenoic acid

  • Molecular FormulaC12H22O2
  • Average mass198.302 Da
  • Monoisotopic mass198.161987 Da
  • ChemSpider ID21865364

More details:

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

(3E)-3-Dodecenoic acid [ACD/IUPAC Name]
(3E)-3-Dodecensäure [German] [ACD/IUPAC Name]
3-dodecenoic acid
3-Dodecenoic acid, (3E)- [ACD/Index Name]
Acide (3E)-3-dodécénoïque [French] [ACD/IUPAC Name]
dodec-3-enoic acid
3024-05-3 [RN]
3-Dodecensaeure
C12:1, n-9

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

Density: 0.9±0.1 g/cm3
Boiling Point: 311.7±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.8±6.0 kJ/mol
Flash Point: 208.7±14.4 °C
Index of Refraction: 1.464
Molar Refractivity: 59.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 77.64
ACD/KOC (pH 5.5): 365.98
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 5.88
Polar Surface Area: 37 Å2
Polarizability: 23.5±0.5 10-24cm3
Surface Tension: 33.9±3.0 dyne/cm
Molar Volume: 214.9±3.0 cm3

Click to predict properties on the Chemicalize site


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