ChemSpider 2D Image | 2-(2-Chlorophenyl)azepane | C12H16ClN

2-(2-Chlorophenyl)azepane

  • Molecular FormulaC12H16ClN
  • Average mass209.715 Da
  • Monoisotopic mass209.097122 Da
  • ChemSpider ID21468644

More details:

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

1H-Azepine, 2-(2-chlorophenyl)hexahydro- [ACD/Index Name]
2-(2-Chlorophenyl)azepane [ACD/IUPAC Name]
2-(2-Chlorophényl)azépane [French] [ACD/IUPAC Name]
2-(2-Chlorophenyl)hexahydro-1H-azepine
2-(2-Chlorphenyl)azepan [German] [ACD/IUPAC Name]
887360-60-3 [RN]
[887360-60-3] [RN]
1H-AZEPINE,2-(2-CHLOROPHENYL)HEXAHYDRO-
2-(2-chlorophenyl)azaperhydroepine
2-(2-CHLORO-PHENYL)-AZEPANE
More...

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

MFCD07357623 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 292.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.2±3.0 kJ/mol
Flash Point: 130.9±25.4 °C
Index of Refraction: 1.527
Molar Refractivity: 60.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.42
ACD/LogD (pH 7.4): 0.82
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.33
Polar Surface Area: 12 Å2
Polarizability: 23.9±0.5 10-24cm3
Surface Tension: 36.4±3.0 dyne/cm
Molar Volume: 196.4±3.0 cm3

Click to predict properties on the Chemicalize site


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