ChemSpider 2D Image | 7-[(1R,2S)-2-(Heptylamino)cyclopentyl]heptanoic acid | C19H37NO2

7-[(1R,2S)-2-(Heptylamino)cyclopentyl]heptanoic acid

  • Molecular FormulaC19H37NO2
  • Average mass311.503 Da
  • Monoisotopic mass311.282440 Da
  • ChemSpider ID34228348

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

7-[(1R,2S)-2-(Heptylamino)cyclopentyl]heptanoic acid [ACD/IUPAC Name]
7-[(1R,2S)-2-(Heptylamino)cyclopentyl]heptansäure [German] [ACD/IUPAC Name]
Acide 7-[(1R,2S)-2-(heptylamino)cyclopentyl]heptanoïque [French] [ACD/IUPAC Name]
Cyclopentaneheptanoic acid, 2-(heptylamino)-, (1R,2S)- [ACD/Index Name]
7-(Cis-2-(heptylamino)cyclopentyl)heptanoic acid
70617-78-6 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 444.3±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 77.0±6.0 kJ/mol
Flash Point: 222.5±21.2 °C
Index of Refraction: 1.484
Molar Refractivity: 93.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 5.83
ACD/LogD (pH 5.5): 3.23
ACD/BCF (pH 5.5): 40.94
ACD/KOC (pH 5.5): 93.19
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 46.39
ACD/KOC (pH 7.4): 105.61
Polar Surface Area: 49 Å2
Polarizability: 37.0±0.5 10-24cm3
Surface Tension: 37.9±5.0 dyne/cm
Molar Volume: 325.7±5.0 cm3

Click to predict properties on the Chemicalize site


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