ChemSpider 2D Image | 2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-7-amine | C9H13N3

2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-7-amine

  • Molecular FormulaC9H13N3
  • Average mass163.220 Da
  • Monoisotopic mass163.110947 Da
  • ChemSpider ID21374198

More details:






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

1H-1,4-Benzodiazepin-7-amine, 2,3,4,5-tetrahydro- [ACD/Index Name]
2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-7-amin [German] [ACD/IUPAC Name]
2,3,4,5-Tetrahydro-1H-1,4-benzodiazepin-7-amine [ACD/IUPAC Name]
2,3,4,5-Tétrahydro-1H-1,4-benzodiazépin-7-amine [French] [ACD/IUPAC Name]
[886366-79-6]
2,3,4,5-tetrahydro-1h-benzo(e)(1,4)diazepin-7-ylamine
2,3,4,5-Tetrahydro-1H-benzo[e][1,4]diazepin-7-
2,3,4,5-Tetrahydro-1H-benzo[e][1,4]diazepin-7-amine
2,3,4,5-Tetrahydro-1H-benzo[e][1,4]diazepin-7-ylamine
886366-79-6 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 375.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 213.4±31.5 °C
Index of Refraction: 1.580
Molar Refractivity: 49.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -3.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 50 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 148.3±3.0 cm3

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