ChemSpider 2D Image | (1,1,1,3,3,3-~2~H_6_)-2-Propanylbenzene | C9H6D6

(1,1,1,3,3,3-2H6)-2-Propanylbenzene

  • Molecular FormulaC9H6D6
  • Average mass126.229 Da
  • Monoisotopic mass126.131561 Da
  • ChemSpider ID23940109

  • Non-standard isotope - Non-standard isotope

More details:

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

(1,1,1,3,3,3-2H6)-2-Propanylbenzene [ACD/IUPAC Name]
(1,1,1,3,3,3-2H6)-2-Propanylbenzène [French] [ACD/IUPAC Name]
(1,1,1,3,3,3-2H6)-2-Propanylbenzol [German] [ACD/IUPAC Name]
(1,1,1,3,3,3-2H6)Propan-2-ylbenzene
Benzene, [1-(methyl-d3)ethyl-2,2,2-d3]- [ACD/Index Name]
20201-29-0 [RN]
2-Phenylpropane-1,1,1,3,3,3-d6
Cumene [Wiki]
Cumene, Isopropylbenzene

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

Density: 0.9±0.1 g/cm3
Boiling Point: 152.4±0.0 °C at 760 mmHg
Vapour Pressure: 4.5±0.1 mmHg at 25°C
Enthalpy of Vaporization: 37.3±0.8 kJ/mol
Flash Point: 46.1±0.0 °C
Index of Refraction: 1.491
Molar Refractivity: 40.4±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.56
ACD/LogD (pH 5.5): 3.67
ACD/BCF (pH 5.5): 360.99
ACD/KOC (pH 5.5): 2356.44
ACD/LogD (pH 7.4): 3.67
ACD/BCF (pH 7.4): 360.99
ACD/KOC (pH 7.4): 2356.44
Polar Surface Area: 0 Å2
Polarizability: 16.0±0.5 10-24cm3
Surface Tension: 28.5±3.0 dyne/cm
Molar Volume: 139.5±3.0 cm3

Click to predict properties on the Chemicalize site


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