Found 88 results

Search term: MF = 'C_{7}H_{6}N_{6}S'
ChemSpider 2D Image | 4,5-Dicyano-1H-imidazol-2-yl N'-methylcarbamimidothioate | C7H6N6S

4,5-Dicyano-1H-imidazol-2-yl N'-methylcarbamimidothioate

  • Molecular FormulaC7H6N6S
  • Average mass206.228 Da
  • Monoisotopic mass206.037460 Da
  • ChemSpider ID57435632

More details:

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

4,5-Dicyan-1H-imidazol-2-yl-N'-methylcarbamimidothioat [German] [ACD/IUPAC Name]
4,5-Dicyano-1H-imidazol-2-yl N'-methylcarbamimidothioate [ACD/IUPAC Name]
Carbamimidothioic acid, N'-methyl-, 4,5-dicyano-1H-imidazol-2-yl ester [ACD/Index Name]
N'-Méthylcarbamimidothioate de 4,5-dicyano-1H-imidazol-2-yle [French] [ACD/IUPAC Name]
62583-64-6 [RN]
CARBAMIMIDOTHIOIC ACID, METHYL-, 4,5-DICYANO-1H-IMIDAZOL-2-YL ESTER

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

Density: 1.5±0.1 g/cm3
Boiling Point: 579.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 304.1±32.9 °C
Index of Refraction: 1.747
Molar Refractivity: 54.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.50
ACD/LogD (pH 5.5): -2.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 140 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 71.7±7.0 dyne/cm
Molar Volume: 134.9±7.0 cm3

Click to predict properties on the Chemicalize site


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