ChemSpider 2D Image | 5-(Chloromethyl)-1-[2-methyl-2-(methylsulfonyl)propyl]-1H-tetrazole | C7H13ClN4O2S

5-(Chloromethyl)-1-[2-methyl-2-(methylsulfonyl)propyl]-1H-tetrazole

  • Molecular FormulaC7H13ClN4O2S
  • Average mass252.722 Da
  • Monoisotopic mass252.044769 Da
  • ChemSpider ID52220189

More details:

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

1H-Tetrazole, 5-(chloromethyl)-1-[2-methyl-2-(methylsulfonyl)propyl]- [ACD/Index Name]
5-(Chlormethyl)-1-[2-methyl-2-(methylsulfonyl)propyl]-1H-tetrazol [German] [ACD/IUPAC Name]
5-(Chloromethyl)-1-[2-methyl-2-(methylsulfonyl)propyl]-1H-tetrazole [ACD/IUPAC Name]
5-(Chlorométhyl)-1-[2-méthyl-2-(méthylsulfonyl)propyl]-1H-tétrazole [French] [ACD/IUPAC 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: 505.4±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.4±28.2 °C
Index of Refraction: 1.602
Molar Refractivity: 59.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.80
ACD/LogD (pH 5.5): -0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 18.19
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.20
Polar Surface Area: 86 Å2
Polarizability: 23.7±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 174.1±7.0 cm3

Click to predict properties on the Chemicalize site


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