ChemSpider 2D Image | (1-Propyl-1H-tetrazol-5-yl)methyl 4-sulfamoylbenzoate | C12H15N5O4S

(1-Propyl-1H-tetrazol-5-yl)methyl 4-sulfamoylbenzoate

  • Molecular FormulaC12H15N5O4S
  • Average mass325.344 Da
  • Monoisotopic mass325.084473 Da
  • ChemSpider ID22468548

More details:

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

(1-Propyl-1H-tetrazol-5-yl)methyl 4-sulfamoylbenzoate [ACD/IUPAC Name]
(1-Propyl-1H-tetrazol-5-yl)methyl-4-sulfamoylbenzoat [German] [ACD/IUPAC Name]
4-Sulfamoylbenzoate de (1-propyl-1H-tétrazol-5-yl)méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(aminosulfonyl)-, (1-propyl-1H-tetrazol-5-yl)methyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 634.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.4±34.3 °C
Index of Refraction: 1.667
Molar Refractivity: 79.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.78
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.17
ACD/KOC (pH 5.5): 38.99
ACD/LogD (pH 7.4): 0.39
ACD/BCF (pH 7.4): 1.17
ACD/KOC (pH 7.4): 38.79
Polar Surface Area: 138 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 65.1±7.0 dyne/cm
Molar Volume: 213.7±7.0 cm3

Click to predict properties on the Chemicalize site


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