ChemSpider 2D Image | 1-[(7R)-Bicyclo[4.2.0]octa-1,3,5-trien-7-yl]methanamine | C9H11N

1-[(7R)-Bicyclo[4.2.0]octa-1,3,5-trien-7-yl]methanamine

  • Molecular FormulaC9H11N
  • Average mass133.190 Da
  • Monoisotopic mass133.089142 Da
  • ChemSpider ID32801255

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-[(7R)-Bicyclo[4.2.0]octa-1,3,5-trien-7-yl]methanamin [German] [ACD/IUPAC Name]
1-[(7R)-Bicyclo[4.2.0]octa-1,3,5-trien-7-yl]methanamine [ACD/IUPAC Name]
1-[(7R)-Bicyclo[4.2.0]octa-1,3,5-trién-7-yl]méthanamine [French] [ACD/IUPAC Name]
Bicyclo[4.2.0]octa-1,3,5-triene-7-methanamine, (7R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 233.9±9.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.1±3.0 kJ/mol
Flash Point: 100.1±6.3 °C
Index of Refraction: 1.585
Molar Refractivity: 42.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.56
ACD/LogD (pH 5.5): -1.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 26 Å2
Polarizability: 16.7±0.5 10-24cm3
Surface Tension: 45.9±3.0 dyne/cm
Molar Volume: 125.5±3.0 cm3

Click to predict properties on the Chemicalize site


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