ChemSpider 2D Image | (1S)-Tricyclo[6.2.1.0~2,7~]undeca-2,4,6-trien-11-amine | C11H13N

(1S)-Tricyclo[6.2.1.02,7]undeca-2,4,6-trien-11-amine

  • Molecular FormulaC11H13N
  • Average mass159.228 Da
  • Monoisotopic mass159.104797 Da
  • ChemSpider ID24683006

  • defined stereocentres - 1 of 3 defined stereocentres

More details:

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

(1S)-Tricyclo[6.2.1.02,7]undeca-2,4,6-trien-11-amin [German] [ACD/IUPAC Name]
(1S)-Tricyclo[6.2.1.02,7]undeca-2,4,6-trien-11-amine [ACD/IUPAC Name]
(1S)-Tricyclo[6.2.1.02,7]undéca-2,4,6-trién-11-amine [French] [ACD/IUPAC Name]
1,4-Methanonaphthalen-9-amine, 1,2,3,4-tetrahydro-, (1S)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL299436/

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

Density: 1.1±0.1 g/cm3
Boiling Point: 265.3±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.3±3.0 kJ/mol
Flash Point: 121.9±19.6 °C
Index of Refraction: 1.607
Molar Refractivity: 49.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.78
Polar Surface Area: 26 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 142.6±3.0 cm3

Click to predict properties on the Chemicalize site


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