ChemSpider 2D Image | 4-[(1-Butyl-1H-tetrazol-5-yl)methyl]-2-methyl-1-(1,3-thiazol-2-yl)piperazine | C14H23N7S

4-[(1-Butyl-1H-tetrazol-5-yl)methyl]-2-methyl-1-(1,3-thiazol-2-yl)piperazine

  • Molecular FormulaC14H23N7S
  • Average mass321.444 Da
  • Monoisotopic mass321.173553 Da
  • ChemSpider ID30338451

More details:

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

4-[(1-Butyl-1H-tetrazol-5-yl)methyl]-2-methyl-1-(1,3-thiazol-2-yl)piperazin [German] [ACD/IUPAC Name]
4-[(1-Butyl-1H-tetrazol-5-yl)methyl]-2-methyl-1-(1,3-thiazol-2-yl)piperazine [ACD/IUPAC Name]
4-[(1-Butyl-1H-tétrazol-5-yl)méthyl]-2-méthyl-1-(1,3-thiazol-2-yl)pipérazine [French] [ACD/IUPAC Name]
Piperazine, 4-[(1-butyl-1H-tetrazol-5-yl)methyl]-2-methyl-1-(2-thiazolyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 512.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.4±3.0 kJ/mol
Flash Point: 263.7±32.9 °C
Index of Refraction: 1.696
Molar Refractivity: 90.9±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.68
ACD/LogD (pH 5.5): 0.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.77
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.79
ACD/KOC (pH 7.4): 104.61
Polar Surface Area: 91 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 55.8±7.0 dyne/cm
Molar Volume: 236.5±7.0 cm3

Click to predict properties on the Chemicalize site


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