ChemSpider 2D Image | (1S,3S)-3-[(Z)-2-Chloro-2-(4-chlorophenyl)vinyl]-2,2-dimethylcyclopropanecarbonyl chloride | C14H13Cl3O

(1S,3S)-3-[(Z)-2-Chloro-2-(4-chlorophenyl)vinyl]-2,2-dimethylcyclopropanecarbonyl chloride

  • Molecular FormulaC14H13Cl3O
  • Average mass303.611 Da
  • Monoisotopic mass302.003204 Da
  • ChemSpider ID103883617

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,3S)-3-[(Z)-2-Chlor-2-(4-chlorphenyl)vinyl]-2,2-dimethylcyclopropancarbonylchlorid [German] [ACD/IUPAC Name]
(1S,3S)-3-[(Z)-2-Chloro-2-(4-chlorophenyl)vinyl]-2,2-dimethylcyclopropanecarbonyl chloride [ACD/IUPAC Name]
78479-05-7 [RN]
Chlorure de (1S,3S)-3-[(Z)-2-chloro-2-(4-chlorophényl)vinyl]-2,2-diméthylcyclopropanecarbonyle [French] [ACD/IUPAC Name]
Cyclopropanecarbonyl chloride, 3-[(Z)-2-chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethyl-, (1S,3S)- [ACD/Index Name]
rel-(1R,3R)-3-[(1Z)-2-Chloro-2-(4-chlorophenyl)ethenyl]-2,2-dimethylcyclopropanecarbonyl chloride

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

Density: 1.4±0.1 g/cm3
Boiling Point: 379.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.8±3.0 kJ/mol
Flash Point: 160.6±27.1 °C
Index of Refraction: 1.620
Molar Refractivity: 78.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.76
ACD/LogD (pH 5.5): 4.85
ACD/BCF (pH 5.5): 2851.25
ACD/KOC (pH 5.5): 10344.50
ACD/LogD (pH 7.4): 4.85
ACD/BCF (pH 7.4): 2851.25
ACD/KOC (pH 7.4): 10344.50
Polar Surface Area: 17 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 222.6±3.0 cm3

Click to predict properties on the Chemicalize site


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