ChemSpider 2D Image | (1S,7R)-1,10,10-Trimethyl-3,4-diazatricyclo[5.2.1.0~2,6~]deca-2,5-dien-4-amine | C11H17N3

(1S,7R)-1,10,10-Trimethyl-3,4-diazatricyclo[5.2.1.02,6]deca-2,5-dien-4-amine

  • Molecular FormulaC11H17N3
  • Average mass191.273 Da
  • Monoisotopic mass191.142242 Da
  • ChemSpider ID110593984

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,7R)-1,10,10-Trimethyl-3,4-diazatricyclo[5.2.1.02,6]deca-2,5-dien-4-amin [German] [ACD/IUPAC Name]
(1S,7R)-1,10,10-Trimethyl-3,4-diazatricyclo[5.2.1.02,6]deca-2,5-dien-4-amine [ACD/IUPAC Name]
(1S,7R)-1,10,10-Triméthyl-3,4-diazatricyclo[5.2.1.02,6]déca-2,5-dién-4-amine [French] [ACD/IUPAC Name]
4,7-Methano-2H-indazol-2-amine, 4,5,6,7-tetrahydro-7,8,8-trimethyl-, (4R,7S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 310.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.1±3.0 kJ/mol
Flash Point: 141.6±28.7 °C
Index of Refraction: 1.687
Molar Refractivity: 55.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 30.06
ACD/KOC (pH 5.5): 337.99
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 52.79
ACD/KOC (pH 7.4): 593.48
Polar Surface Area: 44 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 144.5±7.0 cm3

Click to predict properties on the Chemicalize site


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