ChemSpider 2D Image | 6-[(Adamantan-1-ylcarbamoyl)amino]hexanoic acid | C17H28N2O3

6-[(Adamantan-1-ylcarbamoyl)amino]hexanoic acid

  • Molecular FormulaC17H28N2O3
  • Average mass308.416 Da
  • Monoisotopic mass308.209991 Da
  • ChemSpider ID23278215

More details:

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

6-[(Adamantan-1-ylcarbamoyl)amino]hexanoic acid [ACD/IUPAC Name]
6-[(Adamantan-1-ylcarbamoyl)amino]hexansäure [German] [ACD/IUPAC Name]
6-[(tricyclo[3.3.1.13,7]dec-1-ylcarbamoyl)amino]hexanoic acid
Acide 6-[(adamantan-1-ylcarbamoyl)amino]hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 6-[[(tricyclo[3.3.1.13,7]dec-1-ylamino)carbonyl]amino]- [ACD/Index Name]
6-(3-adamantan-1-yl-ureido)-hexanoic acid
Urea-based compound, 16

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

Density: 1.2±0.1 g/cm3
Boiling Point: 544.4±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 90.0±6.0 kJ/mol
Flash Point: 283.0±24.3 °C
Index of Refraction: 1.554
Molar Refractivity: 83.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 10.90
ACD/KOC (pH 5.5): 112.05
ACD/LogD (pH 7.4): 0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.79
Polar Surface Area: 78 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 50.6±5.0 dyne/cm
Molar Volume: 261.2±5.0 cm3

Click to predict properties on the Chemicalize site


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