ChemSpider 2D Image | O-Methyl (2-methylphenyl)carbamothioate | C9H11NOS

O-Methyl (2-methylphenyl)carbamothioate

  • Molecular FormulaC9H11NOS
  • Average mass181.255 Da
  • Monoisotopic mass181.056137 Da
  • ChemSpider ID30653881

More details:

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

(2-Méthylphényl)carbamothioate de O-méthyle [French] [ACD/IUPAC Name]
895572-04-0 [RN]
Carbamothioic acid, N-(2-methylphenyl)-, O-methyl ester [ACD/Index Name]
O-Methyl (2-methylphenyl)carbamothioate [ACD/IUPAC Name]
O-Methyl N-(2-methylphenyl)carbamothioate
O-Methyl-(2-methylphenyl)carbamothioat [German] [ACD/IUPAC Name]
MFCD24585967

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

Density: 1.2±0.1 g/cm3
Boiling Point: 241.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.8±3.0 kJ/mol
Flash Point: 99.7±25.4 °C
Index of Refraction: 1.629
Molar Refractivity: 54.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.54
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 26.93
ACD/KOC (pH 5.5): 367.57
ACD/LogD (pH 7.4): 2.18
ACD/BCF (pH 7.4): 26.93
ACD/KOC (pH 7.4): 367.56
Polar Surface Area: 53 Å2
Polarizability: 21.5±0.5 10-24cm3
Surface Tension: 51.4±3.0 dyne/cm
Molar Volume: 153.0±3.0 cm3

Click to predict properties on the Chemicalize site


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