ChemSpider 2D Image | 6-[(S)-(4-Chlorophenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-(~11~C)methyl-1H-benzotriazole | C1511CH13ClN6

6-[(S)-(4-Chlorophenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-(11C)methyl-1H-benzotriazole

  • Molecular FormulaC1511CH13ClN6
  • Average mass323.768 Da
  • Monoisotopic mass323.100464 Da
  • ChemSpider ID4575220

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

1H-1,2,3-Benzotriazole, 6-[(S)-(4-chlorophenyl)-1H-1,2,4-triazol-1-ylmethyl]-1-(methyl-11C)- [ACD/Index Name]
6-[(S)-(4-Chlorophenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-(11C)methyl-1H-benzotriazole [ACD/IUPAC Name]
6-[(S)-(4-Chlorophényl)(1H-1,2,4-triazol-1-yl)méthyl]-1-(11C)méthyl-1H-benzotriazole [French] [ACD/IUPAC Name]
6-[(S)-(4-Chlorphenyl)(1H-1,2,4-triazol-1-yl)methyl]-1-(11C)methyl-1H-benzotriazol [German] [ACD/IUPAC Name]

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

MOLI000346 [DBID]
MOLI001539 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.739
Molar Refractivity: 90.6±0.5 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 225.0±7.0 cm3

Click to predict properties on the Chemicalize site


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