ChemSpider 2D Image | N-(2-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-2-thiophenecarboxamide | C12H13N3OS

N-(2-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-2-thiophenecarboxamide

  • Molecular FormulaC12H13N3OS
  • Average mass247.316 Da
  • Monoisotopic mass247.077927 Da
  • ChemSpider ID22527699

More details:

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

2-Thiophenecarboxamide, N-(2,4,5,6-tetrahydro-2-methylcyclopenta[c]pyrazol-3-yl)- [ACD/Index Name]
N-(2-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-(2-Methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-2-thiophenecarboxamide [ACD/IUPAC Name]
N-(2-Méthyl-2,4,5,6-tétrahydrocyclopenta[c]pyrazol-3-yl)-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
N-(2-methyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)thiophene-2-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 332.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.6±3.0 kJ/mol
Flash Point: 155.1±27.9 °C
Index of Refraction: 1.735
Molar Refractivity: 68.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 2.25
ACD/BCF (pH 5.5): 29.98
ACD/KOC (pH 5.5): 396.31
ACD/LogD (pH 7.4): 2.25
ACD/BCF (pH 7.4): 30.14
ACD/KOC (pH 7.4): 398.47
Polar Surface Area: 75 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 171.4±7.0 cm3

Click to predict properties on the Chemicalize site


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