ChemSpider 2D Image | 1-(Chloromethyl)-1,3,5-cycloheptatriene | C8H9Cl

1-(Chloromethyl)-1,3,5-cycloheptatriene

  • Molecular FormulaC8H9Cl
  • Average mass140.610 Da
  • Monoisotopic mass140.039276 Da
  • ChemSpider ID32995192

More details:

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

1-(Chlormethyl)-1,3,5-cycloheptatrien [German] [ACD/IUPAC Name]
1-(Chloromethyl)-1,3,5-cycloheptatriene [ACD/IUPAC Name]
1-(Chlorométhyl)-1,3,5-cycloheptatriène [French] [ACD/IUPAC Name]
1,3,5-Cycloheptatriene, 1-(chloromethyl)- [ACD/Index Name]
1-(Chloromethyl)cyclohepta-1,3,5-triene
65810-26-6 [RN]
MFCD19232482

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

Density: 1.0±0.1 g/cm3
Boiling Point: 192.6±19.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.4 mmHg at 25°C
Enthalpy of Vaporization: 41.1±3.0 kJ/mol
Flash Point: 66.7±9.0 °C
Index of Refraction: 1.516
Molar Refractivity: 40.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 3.03
ACD/BCF (pH 5.5): 118.16
ACD/KOC (pH 5.5): 1059.48
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 118.16
ACD/KOC (pH 7.4): 1059.48
Polar Surface Area: 0 Å2
Polarizability: 16.1±0.5 10-24cm3
Surface Tension: 31.6±3.0 dyne/cm
Molar Volume: 134.5±3.0 cm3

Click to predict properties on the Chemicalize site


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