ChemSpider 2D Image | 1,3,4-Thiadiazol-2-ylcarbamodithioic acid | C3H3N3S3

1,3,4-Thiadiazol-2-ylcarbamodithioic acid

  • Molecular FormulaC3H3N3S3
  • Average mass177.271 Da
  • Monoisotopic mass176.948914 Da
  • ChemSpider ID60806687

More details:

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

1,3,4-Thiadiazol-2-ylcarbamodithioic acid [ACD/IUPAC Name]
1,3,4-Thiadiazol-2-ylcarbamodithiosäure [German] [ACD/IUPAC Name]
Acide 1,3,4-thiadiazol-2-ylcarbamodithioïque [French] [ACD/IUPAC Name]
Carbamodithioic acid, N-1,3,4-thiadiazol-2-yl- [ACD/Index Name]
53216-31-2 [RN]
MFCD24571621

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

Density: 1.7±0.1 g/cm3
Boiling Point: 284.6±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 125.9±22.6 °C
Index of Refraction: 1.830
Molar Refractivity: 45.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.05
ACD/LogD (pH 5.5): -2.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 137 Å2
Polarizability: 18.1±0.5 10-24cm3
Surface Tension: 109.6±3.0 dyne/cm
Molar Volume: 103.9±3.0 cm3

Click to predict properties on the Chemicalize site


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