ChemSpider 2D Image | 1,3-Benzothiazol-2-yl carbamodithioate | C8H6N2S3

1,3-Benzothiazol-2-yl carbamodithioate

  • Molecular FormulaC8H6N2S3
  • Average mass226.342 Da
  • Monoisotopic mass225.969315 Da
  • ChemSpider ID57435655

More details:

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

1,3-Benzothiazol-2-yl carbamodithioate [ACD/IUPAC Name]
1,3-Benzothiazol-2-ylcarbamodithioat [German] [ACD/IUPAC Name]
Carbamodithioate de 1,3-benzothiazol-2-yle [French] [ACD/IUPAC Name]
Carbamodithioic acid, 2-benzothiazolyl ester [ACD/Index Name]
42268-24-6 [RN]
Benzo[d]thiazol-2-yl carbamodithioate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 407.9±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 200.5±24.0 °C
Index of Refraction: 1.817
Molar Refractivity: 63.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.14
ACD/LogD (pH 5.5): 2.20
ACD/BCF (pH 5.5): 27.52
ACD/KOC (pH 5.5): 373.35
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 27.52
ACD/KOC (pH 7.4): 373.33
Polar Surface Area: 125 Å2
Polarizability: 25.2±0.5 10-24cm3
Surface Tension: 95.1±5.0 dyne/cm
Molar Volume: 146.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement