ChemSpider 2D Image | Metizolam | C16H13ClN4S

Metizolam

  • Molecular FormulaC16H13ClN4S
  • Average mass328.819 Da
  • Monoisotopic mass328.054932 Da
  • ChemSpider ID59207712

More details:

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

4-(2-Chlorophenyl)-2-ethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine [ACD/IUPAC Name]
4-(2-Chlorophényl)-2-éthyl-6H-thiéno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazépine [French] [ACD/IUPAC Name]
4-(2-Chlorphenyl)-2-ethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin [German] [ACD/IUPAC Name]
40054-68-0 [RN]
6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, 4-(2-chlorophenyl)-2-ethyl- [ACD/Index Name]
Desmethyletizolam
Metizolam [Wiki]
7-(2-chlorophenyl)-4-ethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene

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

Density: 1.5±0.1 g/cm3
Boiling Point: 527.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.2±3.0 kJ/mol
Flash Point: 272.6±32.9 °C
Index of Refraction: 1.752
Molar Refractivity: 91.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.39
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 76.49
ACD/KOC (pH 5.5): 775.87
ACD/LogD (pH 7.4): 2.78
ACD/BCF (pH 7.4): 76.54
ACD/KOC (pH 7.4): 776.45
Polar Surface Area: 71 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 57.6±7.0 dyne/cm
Molar Volume: 224.0±7.0 cm3

Click to predict properties on the Chemicalize site


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