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ChemSpider 2D Image | 4-chloraniline | C6H6ClN


  • Molecular FormulaC6H6ClN
  • Average mass127.572 Da
  • Monoisotopic mass127.018877 Da
  • ChemSpider ID7524

More details:

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

106-47-8 [RN]
4-Chloranilin [Czech] [ACD/IUPAC Name]
4-Chloroaniline [ACD/IUPAC Name]

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

Density: 1.2±0.0 g/cm3
Boiling Point: 232.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.0 mmHg at 25°C
Enthalpy of Vaporization: 46.9±0.0 kJ/mol
Flash Point: 89.5±0.0 °C
Index of Refraction: 1.598
Molar Refractivity: 35.4±0.0 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 12.35
ACD/KOC (pH 5.5): 208.70
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 12.71
ACD/KOC (pH 7.4): 214.73
Polar Surface Area: 26 Å2
Polarizability: 14.0±0.0 10-24cm3
Surface Tension: 45.3±0.0 dyne/cm
Molar Volume: 103.6±0.0 cm3

Click to predict properties on the Chemicalize site