ChemSpider 2D Image | (1R,2S,3S,4S,6S)-3-Aminotricyclo[2.2.1.0~2,6~]heptane-3-carboxylic acid | C8H11NO2

(1R,2S,3S,4S,6S)-3-Aminotricyclo[2.2.1.02,6]heptane-3-carboxylic acid

  • Molecular FormulaC8H11NO2
  • Average mass153.178 Da
  • Monoisotopic mass153.078979 Da
  • ChemSpider ID34948479

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(1R,2S,3S,4S,6S)-3-Aminotricyclo[2.2.1.02,6]heptan-3-carbonsäure [German] [ACD/IUPAC Name]
(1R,2S,3S,4S,6S)-3-Aminotricyclo[2.2.1.02,6]heptane-3-carboxylic acid [ACD/IUPAC Name]
Acide (1R,2S,3S,4S,6S)-3-aminotricyclo[2.2.1.02,6]heptane-3-carboxylique [French] [ACD/IUPAC Name]
Tricyclo[2.2.1.02,6]heptane-3-carboxylic acid, 3-amino-, (1R,3S,6S)- [ACD/Index Name]
WAY-879

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

Density: 1.5±0.1 g/cm3
Boiling Point: 306.6±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 60.2±6.0 kJ/mol
Flash Point: 139.2±23.2 °C
Index of Refraction: 1.647
Molar Refractivity: 38.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): -2.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 15.0±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 104.5±3.0 cm3

Click to predict properties on the Chemicalize site


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