ChemSpider 2D Image | (5-Chloro-2-thienyl){3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azetidinyl}methanone | C11H11ClN4O3S2

(5-Chloro-2-thienyl){3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azetidinyl}methanone

  • Molecular FormulaC11H11ClN4O3S2
  • Average mass346.813 Da
  • Monoisotopic mass345.996094 Da
  • ChemSpider ID35011528

More details:

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

(5-Chlor-2-thienyl){3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azetidinyl}methanon [German] [ACD/IUPAC Name]
(5-Chloro-2-thienyl){3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azetidinyl}methanone [ACD/IUPAC Name]
(5-Chloro-2-thiényl){3-[(4-méthyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azétidinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, (5-chloro-2-thienyl)[3-[(4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl]-1-azetidinyl]- [ACD/Index Name]
(5-chlorothiophen-2-yl)(3-((4-methyl-4H-1,2,4-triazol-3-yl)sulfonyl)azetidin-1-yl)methanone
2034521-61-2 [RN]
3-{[1-(5-chlorothiophene-2-carbonyl)azetidin-3-yl]sulfonyl}-4-methyl-4H-1,2,4-triazole

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

Density: 1.8±0.1 g/cm3
Boiling Point: 610.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 322.9±34.3 °C
Index of Refraction: 1.784
Molar Refractivity: 82.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 46.09
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.48
ACD/KOC (pH 7.4): 46.09
Polar Surface Area: 122 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 77.1±7.0 dyne/cm
Molar Volume: 195.7±7.0 cm3

Click to predict properties on the Chemicalize site


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