ChemSpider 2D Image | [(1R,2S)-2-Isopropylcyclopropyl]benzene | C12H16

[(1R,2S)-2-Isopropylcyclopropyl]benzene

  • Molecular FormulaC12H16
  • Average mass160.255 Da
  • Monoisotopic mass160.125198 Da
  • ChemSpider ID29321681

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(1R,2S)-2-Isopropylcyclopropyl]benzene [ACD/IUPAC Name]
[(1R,2S)-2-Isopropylcyclopropyl]benzène [French] [ACD/IUPAC Name]
[(1R,2S)-2-Isopropylcyclopropyl]benzol [German] [ACD/IUPAC Name]
Benzene, [(1R,2S)-2-(1-methylethyl)cyclopropyl]- [ACD/Index Name]
((1R,2S)-2-isopropylcyclopropyl)benzene
72359-62-7 [RN]
trans-2-phenyl-isopropylcyclopropane

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

Density: 0.9±0.1 g/cm3
Boiling Point: 222.2±7.0 °C at 760 mmHg
Vapour Pressure: 0.2±0.2 mmHg at 25°C
Enthalpy of Vaporization: 44.0±0.8 kJ/mol
Flash Point: 80.1±8.5 °C
Index of Refraction: 1.527
Molar Refractivity: 52.1±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 900.97
ACD/KOC (pH 5.5): 4535.04
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 900.97
ACD/KOC (pH 7.4): 4535.04
Polar Surface Area: 0 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 33.7±3.0 dyne/cm
Molar Volume: 169.5±3.0 cm3

Click to predict properties on the Chemicalize site


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