ChemSpider 2D Image | 5-Chloro-2'-(methylsulfanyl)-3-biphenylol | C13H11ClOS

5-Chloro-2'-(methylsulfanyl)-3-biphenylol

  • Molecular FormulaC13H11ClOS
  • Average mass250.744 Da
  • Monoisotopic mass250.021912 Da
  • ChemSpider ID30999314

More details:

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

[1,1'-Biphenyl]-3-ol, 5-chloro-2'-(methylthio)- [ACD/Index Name]
5-Chlor-2'-(methylsulfanyl)-3-biphenylol [German] [ACD/IUPAC Name]
5-Chloro-2'-(methylsulfanyl)-3-biphenylol [ACD/IUPAC Name]
5-Chloro-2'-(méthylsulfanyl)-3-biphénylol [French] [ACD/IUPAC Name]
1262002-23-2 [RN]
3-Chloro-5-(2-methylthiophenyl)phenol
5-Chloro-2'-(methylthio)-[1,1'-biphenyl]-3-ol
YA-4678

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

Density: 1.3±0.1 g/cm3
Boiling Point: 413.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 204.1±27.3 °C
Index of Refraction: 1.670
Molar Refractivity: 70.5±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2925.81
ACD/KOC (pH 5.5): 10535.35
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2775.35
ACD/KOC (pH 7.4): 9993.56
Polar Surface Area: 46 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 57.9±5.0 dyne/cm
Molar Volume: 188.6±5.0 cm3

Click to predict properties on the Chemicalize site


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