ChemSpider 2D Image | (3-~2~H)-1,3-Butadien-2-ylbenzene | C10H9D

(3-2H)-1,3-Butadien-2-ylbenzene

  • Molecular FormulaC10H9D
  • Average mass131.193 Da
  • Monoisotopic mass131.084534 Da
  • ChemSpider ID77416538
  • Non-standard isotope - Non-standard isotope


More details:






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

(3-2H)-1,3-Butadien-2-ylbenzene [ACD/IUPAC Name]
(3-2H)-1,3-Butadién-2-ylbenzène [French] [ACD/IUPAC Name]
(3-2H)-1,3-Butadien-2-ylbenzol [German] [ACD/IUPAC Name]
Benzene, (1-methylene-2-propen-1-yl-2-d)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 180.1±7.0 °C at 760 mmHg
Vapour Pressure: 1.2±0.2 mmHg at 25°C
Enthalpy of Vaporization: 39.9±0.8 kJ/mol
Flash Point: 54.0±6.7 °C
Index of Refraction: 1.522
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 278.13
ACD/KOC (pH 5.5): 1955.24
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 278.13
ACD/KOC (pH 7.4): 1955.24
Polar Surface Area: 0 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 29.1±3.0 dyne/cm
Molar Volume: 146.8±3.0 cm3

Click to predict properties on the Chemicalize site






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