ChemSpider 2D Image | (3R)-3-Amino-5,7,7-trimethyloctanoic acid | C11H23NO2

(3R)-3-Amino-5,7,7-trimethyloctanoic acid

  • Molecular FormulaC11H23NO2
  • Average mass201.306 Da
  • Monoisotopic mass201.172882 Da
  • ChemSpider ID98148330
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

(3R)-3-Amino-5,7,7-trimethyloctanoic acid [ACD/IUPAC Name]
(3R)-3-Amino-5,7,7-trimethyloctansäure [German] [ACD/IUPAC Name]
Acide (3R)-3-amino-5,7,7-triméthyloctanoïque [French] [ACD/IUPAC Name]
Octanoic acid, 3-amino-5,7,7-trimethyl-, (3R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 304.1±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 59.9±6.0 kJ/mol
Flash Point: 137.7±23.2 °C
Index of Refraction: 1.466
Molar Refractivity: 58.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 0.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.77
ACD/LogD (pH 7.4): 0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.79
Polar Surface Area: 63 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 35.4±3.0 dyne/cm
Molar Volume: 209.2±3.0 cm3

Click to predict properties on the Chemicalize site






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