ChemSpider 2D Image | (2S)-2,8-Diaminooctanoic acid | C8H18N2O2

(2S)-2,8-Diaminooctanoic acid

  • Molecular FormulaC8H18N2O2
  • Average mass174.241 Da
  • Monoisotopic mass174.136826 Da
  • ChemSpider ID25056746

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2,8-Diaminooctanoic acid [ACD/IUPAC Name]
(2S)-2,8-Diaminooctansäure [German] [ACD/IUPAC Name]
Acide (2S)-2,8-diaminooctanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 2,8-diamino-, (2S)- [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: 340.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.1±6.0 kJ/mol
Flash Point: 159.4±25.1 °C
Index of Refraction: 1.497
Molar Refractivity: 47.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 0.03
ACD/LogD (pH 5.5): -3.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 89 Å2
Polarizability: 18.9±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 162.9±3.0 cm3

Click to predict properties on the Chemicalize site


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