ChemSpider 2D Image | MFCD22666444 | C9H7NS2

MFCD22666444

  • Molecular FormulaC9H7NS2
  • Average mass193.289 Da
  • Monoisotopic mass193.001984 Da
  • ChemSpider ID29542432

More details:






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

28740-46-7 [RN]
Benzènecarbodithioate de cyanométhyle [French] [ACD/IUPAC Name]
Benzenecarbodithioic acid, cyanomethyl ester [ACD/Index Name]
Cyanmethyl-benzolcarbodithioat [German] [ACD/IUPAC Name]
Cyanomethyl benzenecarbodithioate [ACD/IUPAC Name]
Cyanomethyl benzodithioate
MFCD22666444

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

Density: 1.3±0.1 g/cm3
Boiling Point: 329.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 153.0±28.4 °C
Index of Refraction: 1.656
Molar Refractivity: 56.1±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.61
ACD/KOC (pH 5.5): 430.76
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.61
ACD/KOC (pH 7.4): 430.76
Polar Surface Area: 81 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 152.7±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement