ChemSpider 2D Image | N-(2-Oxotetrahydro-3-thiophenyl)-2-[4-(trifluoromethoxy)phenyl]-2H-tetrazole-5-carboxamide | C13H10F3N5O3S

N-(2-Oxotetrahydro-3-thiophenyl)-2-[4-(trifluoromethoxy)phenyl]-2H-tetrazole-5-carboxamide

  • Molecular FormulaC13H10F3N5O3S
  • Average mass373.310 Da
  • Monoisotopic mass373.045654 Da
  • ChemSpider ID30748001

More details:

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

2H-Tetrazole-5-carboxamide, N-(tetrahydro-2-oxo-3-thienyl)-2-[4-(trifluoromethoxy)phenyl]- [ACD/Index Name]
N-(2-Oxotetrahydro-3-thiophenyl)-2-[4-(trifluormethoxy)phenyl]-2H-tetrazol-5-carboxamid [German] [ACD/IUPAC Name]
N-(2-Oxotetrahydro-3-thiophenyl)-2-[4-(trifluoromethoxy)phenyl]-2H-tetrazole-5-carboxamide [ACD/IUPAC Name]
N-(2-Oxotétrahydro-3-thiophényl)-2-[4-(trifluorométhoxy)phényl]-2H-tétrazole-5-carboxamide [French] [ACD/IUPAC Name]
1396792-17-8 [RN]
N-(2-oxotetrahydrothiophen-3-yl)-2-(4-(trifluoromethoxy)phenyl)-2H-tetrazole-5-carboxamide
N-(2-oxothiolan-3-yl)-2-[4-(trifluoromethoxy)phenyl]-2H-1,2,3,4-tetrazole-5-carboxamide

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 82.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 1.15
ACD/BCF (pH 5.5): 4.26
ACD/KOC (pH 5.5): 94.60
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.86
Polar Surface Area: 124 Å2
Polarizability: 32.5±0.5 10-24cm3
Surface Tension: 60.2±7.0 dyne/cm
Molar Volume: 215.6±7.0 cm3

Click to predict properties on the Chemicalize site


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