ChemSpider 2D Image | (1S,2R,5R)-2-Isopropyl-5-methylcyclohexanamine | C10H21N

(1S,2R,5R)-2-Isopropyl-5-methylcyclohexanamine

  • Molecular FormulaC10H21N
  • Average mass155.280 Da
  • Monoisotopic mass155.167404 Da
  • ChemSpider ID60615116

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1S,2R,5R)-2-Isopropyl-5-methylcyclohexanamin [German] [ACD/IUPAC Name]
(1S,2R,5R)-2-Isopropyl-5-methylcyclohexanamine [ACD/IUPAC Name]
(1S,2R,5R)-2-Isopropyl-5-méthylcyclohexanamine [French] [ACD/IUPAC Name]
Cyclohexanamine, 5-methyl-2-(1-methylethyl)-, (1S,2R,5R)- [ACD/Index Name]
160399-90-6 [RN]
4894-99-9 [RN]
MFCD20690599

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

Density: 0.8±0.1 g/cm3
Boiling Point: 192.8±8.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.9±3.0 kJ/mol
Flash Point: 45.8±9.7 °C
Index of Refraction: 1.448
Molar Refractivity: 49.8±0.3 cm3
#H bond acceptors: 1
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.12
ACD/LogD (pH 7.4): 0.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.83
Polar Surface Area: 26 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 26.6±3.0 dyne/cm
Molar Volume: 186.1±3.0 cm3

Click to predict properties on the Chemicalize site


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