Found 42 results

Search term: MF = 'C_{9}H_{13}ClN_{6}O_{2}S'
ChemSpider 2D Image | 5-Chloro-N,1-dimethyl-N-[(3-methyl-1H-1,2,4-triazol-5-yl)methyl]-1H-imidazole-4-sulfonamide | C9H13ClN6O2S

5-Chloro-N,1-dimethyl-N-[(3-methyl-1H-1,2,4-triazol-5-yl)methyl]-1H-imidazole-4-sulfonamide

  • Molecular FormulaC9H13ClN6O2S
  • Average mass304.757 Da
  • Monoisotopic mass304.050934 Da
  • ChemSpider ID46287134

More details:

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

1H-Imidazole-4-sulfonamide, 5-chloro-N,1-dimethyl-N-[(3-methyl-1H-1,2,4-triazol-5-yl)methyl]- [ACD/Index Name]
5-Chlor-N,1-dimethyl-N-[(3-methyl-1H-1,2,4-triazol-5-yl)methyl]-1H-imidazol-4-sulfonamid [German] [ACD/IUPAC Name]
5-Chloro-N,1-dimethyl-N-[(3-methyl-1H-1,2,4-triazol-5-yl)methyl]-1H-imidazole-4-sulfonamide [ACD/IUPAC Name]
5-Chloro-N,1-diméthyl-N-[(3-méthyl-1H-1,2,4-triazol-5-yl)méthyl]-1H-imidazole-4-sulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 617.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 327.1±34.3 °C
Index of Refraction: 1.702
Molar Refractivity: 72.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.81
ACD/LogD (pH 5.5): 0.66
ACD/BCF (pH 5.5): 1.87
ACD/KOC (pH 5.5): 54.49
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.88
ACD/KOC (pH 7.4): 54.62
Polar Surface Area: 105 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 61.8±7.0 dyne/cm
Molar Volume: 188.0±7.0 cm3

Click to predict properties on the Chemicalize site


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