ChemSpider 2D Image | (1S,4S,6S)-7,7-Dichloro-4-(2-chloro-2-propanyl)-1-(2,2,2-trichloroethyl)bicyclo[4.1.0]heptane | C12H16Cl6

(1S,4S,6S)-7,7-Dichloro-4-(2-chloro-2-propanyl)-1-(2,2,2-trichloroethyl)bicyclo[4.1.0]heptane

  • Molecular FormulaC12H16Cl6
  • Average mass372.973 Da
  • Monoisotopic mass369.938324 Da
  • ChemSpider ID30653972

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1S,4S,6S)-7,7-Dichlor-4-(2-chlor-2-propanyl)-1-(2,2,2-trichlorethyl)bicyclo[4.1.0]heptan [German] [ACD/IUPAC Name]
(1S,4S,6S)-7,7-Dichloro-4-(2-chloro-2-propanyl)-1-(2,2,2-trichloroethyl)bicyclo[4.1.0]heptane [ACD/IUPAC Name]
(1S,4S,6S)-7,7-Dichloro-4-(2-chloro-2-propanyl)-1-(2,2,2-trichloroéthyl)bicyclo[4.1.0]heptane [French] [ACD/IUPAC Name]
Bicyclo[4.1.0]heptane, 7,7-dichloro-4-(1-chloro-1-methylethyl)-1-(2,2,2-trichloroethyl)-, (1S,4S,6S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 396.0±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 186.4±21.1 °C
Index of Refraction: 1.545
Molar Refractivity: 82.5±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 5.64
ACD/BCF (pH 5.5): 11412.51
ACD/KOC (pH 5.5): 27916.59
ACD/LogD (pH 7.4): 5.64
ACD/BCF (pH 7.4): 11412.51
ACD/KOC (pH 7.4): 27916.59
Polar Surface Area: 0 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 42.4±5.0 dyne/cm
Molar Volume: 261.1±5.0 cm3

Click to predict properties on the Chemicalize site


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