ChemSpider 2D Image | (6,6,7,7,8,8-~2~H_6_)-6,7,8,9-Tetrahydro-5H-tetrazolo[1,5-a]azepine | C6H4D6N4

(6,6,7,7,8,8-2H6)-6,7,8,9-Tetrahydro-5H-tetrazolo[1,5-a]azepine

  • Molecular FormulaC6H4D6N4
  • Average mass144.207 Da
  • Monoisotopic mass144.128204 Da
  • ChemSpider ID48062284

  • Non-standard isotope - Non-standard isotope

More details:

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

(6,6,7,7,8,8-2H6)-6,7,8,9-Tetrahydro-5H-tetrazolo[1,5-a]azepin [German] [ACD/IUPAC Name]
(6,6,7,7,8,8-2H6)-6,7,8,9-Tetrahydro-5H-tetrazolo[1,5-a]azepine [ACD/IUPAC Name]
(6,6,7,7,8,8-2H6)-6,7,8,9-Tétrahydro-5H-tétrazolo[1,5-a]azépine [French] [ACD/IUPAC Name]
5H-Tetrazolo[1,5-a]azepine-6,7,8-d3, 6,7,8,9-tetrahydro-6,7,8-d3- [ACD/Index Name]
1329509-68-3 [RN]
6,6,7,7,8,8-hexadeuterio-5,9-dihydrotetrazolo[1,5-a]azepine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 339.3±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 159.0±19.3 °C
Index of Refraction: 1.719
Molar Refractivity: 38.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.14
ACD/LogD (pH 5.5): 0.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.31
ACD/LogD (pH 7.4): 0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 31.32
Polar Surface Area: 44 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 60.2±7.0 dyne/cm
Molar Volume: 96.8±7.0 cm3

Click to predict properties on the Chemicalize site


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