ChemSpider 2D Image | 2-Hydroxy-4-(2-thienyl)benzonitrile | C11H7NOS

2-Hydroxy-4-(2-thienyl)benzonitrile

  • Molecular FormulaC11H7NOS
  • Average mass201.244 Da
  • Monoisotopic mass201.024841 Da
  • ChemSpider ID26524714

More details:

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

2-Hydroxy-4-(2-thienyl)benzonitril [German] [ACD/IUPAC Name]
2-Hydroxy-4-(2-thienyl)benzonitrile [ACD/IUPAC Name]
2-Hydroxy-4-(2-thiényl)benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 2-hydroxy-4-(2-thienyl)- [ACD/Index Name]
1261972-90-0 [RN]
2-Cyano-5-(thiophen-2-yl)phenol
2-Hydroxy-4-(thiophen-2-yl)benzonitrile
MFCD18314134
YA-3048

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

Density: 1.4±0.1 g/cm3
Boiling Point: 398.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 195.1±27.9 °C
Index of Refraction: 1.680
Molar Refractivity: 55.7±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.05
ACD/LogD (pH 5.5): 2.90
ACD/BCF (pH 5.5): 94.02
ACD/KOC (pH 5.5): 887.87
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 20.76
ACD/KOC (pH 7.4): 196.05
Polar Surface Area: 72 Å2
Polarizability: 22.1±0.5 10-24cm3
Surface Tension: 69.1±5.0 dyne/cm
Molar Volume: 147.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement