ChemSpider 2D Image | (7S,8R)-7,8-Diaminononanoic acid | C9H20N2O2

(7S,8R)-7,8-Diaminononanoic acid

  • Molecular FormulaC9H20N2O2
  • Average mass188.267 Da
  • Monoisotopic mass188.152481 Da
  • ChemSpider ID78273155
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(7S,8R)-7,8-Diaminononanoic acid [ACD/IUPAC Name]
(7S,8R)-7,8-Diaminononansäure [German] [ACD/IUPAC Name]
Acide (7S,8R)-7,8-diaminononanoïque [French] [ACD/IUPAC Name]
Nonanoic acid, 7,8-diamino-, (7S,8R)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.0±0.1 g/cm3
Boiling Point: 349.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 65.3±6.0 kJ/mol
Flash Point: 165.3±25.1 °C
Index of Refraction: 1.493
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -0.79
ACD/LogD (pH 5.5): -4.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 179.8±3.0 cm3

Click to predict properties on the Chemicalize site






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