ChemSpider 2D Image | 7-Chloro-4-(2-phenylethyl)-2H-1,4-benzoxazin-3(4H)-one | C16H14ClNO2

7-Chloro-4-(2-phenylethyl)-2H-1,4-benzoxazin-3(4H)-one

  • Molecular FormulaC16H14ClNO2
  • Average mass287.741 Da
  • Monoisotopic mass287.071320 Da
  • ChemSpider ID24741886

More details:

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

2H-1,4-Benzoxazin-3(4H)-one, 7-chloro-4-(2-phenylethyl)- [ACD/Index Name]
7-Chlor-4-(2-phenylethyl)-2H-1,4-benzoxazin-3(4H)-on [German] [ACD/IUPAC Name]
7-Chloro-4-(2-phenylethyl)-2H-1,4-benzoxazin-3(4H)-one [ACD/IUPAC Name]
7-Chloro-4-(2-phényléthyl)-2H-1,4-benzoxazin-3(4H)-one [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 528.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 273.3±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 77.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 3.89
ACD/BCF (pH 5.5): 531.74
ACD/KOC (pH 5.5): 3109.25
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 531.74
ACD/KOC (pH 7.4): 3109.29
Polar Surface Area: 30 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 225.1±3.0 cm3

Click to predict properties on the Chemicalize site


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