ChemSpider 2D Image | 1-Chloro-1,3,5-cycloheptatriene | C7H7Cl

1-Chloro-1,3,5-cycloheptatriene

  • Molecular FormulaC7H7Cl
  • Average mass126.584 Da
  • Monoisotopic mass126.023628 Da
  • ChemSpider ID62896052

More details:






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

1,3,5-Cycloheptatriene, 1-chloro- [ACD/Index Name]
1-Chlor-1,3,5-cycloheptatrien [German] [ACD/IUPAC Name]
1-Chloro-1,3,5-cycloheptatriene [ACD/IUPAC Name]
1-Chloro-1,3,5-cycloheptatriène [French] [ACD/IUPAC Name]
32743-66-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 187.0±9.0 °C at 760 mmHg
Vapour Pressure: 0.9±0.3 mmHg at 25°C
Enthalpy of Vaporization: 40.6±3.0 kJ/mol
Flash Point: 62.5±14.1 °C
Index of Refraction: 1.541
Molar Refractivity: 36.7±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 141.05
ACD/KOC (pH 5.5): 1202.64
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.05
ACD/KOC (pH 7.4): 1202.64
Polar Surface Area: 0 Å2
Polarizability: 14.6±0.5 10-24cm3
Surface Tension: 32.4±5.0 dyne/cm
Molar Volume: 116.9±5.0 cm3

Click to predict properties on the Chemicalize site






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