ChemSpider 2D Image | 1-({1-[(3s,5s,7s)-Adamantan-1-ylmethyl]-4-piperidinyl}methyl)-4-piperidinol | C22H38N2O

1-({1-[(3s,5s,7s)-Adamantan-1-ylmethyl]-4-piperidinyl}methyl)-4-piperidinol

  • Molecular FormulaC22H38N2O
  • Average mass346.550 Da
  • Monoisotopic mass346.298401 Da
  • ChemSpider ID114935381

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1-({1-[(3s,5s,7s)-Adamantan-1-ylmethyl]-4-piperidinyl}methyl)-4-piperidinol [German] [ACD/IUPAC Name]
1-({1-[(3s,5s,7s)-Adamantan-1-ylmethyl]-4-piperidinyl}methyl)-4-piperidinol [ACD/IUPAC Name]
1-({1-[(3s,5s,7s)-Adamantan-1-ylméthyl]-4-pipéridinyl}méthyl)-4-pipéridinol [French] [ACD/IUPAC Name]
4-Piperidinol, 1-[[1-(tricyclo[3.3.1.13,7]dec-1-ylmethyl)-4-piperidinyl]methyl]- [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: 479.0±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.7±6.0 kJ/mol
Flash Point: 223.8±20.4 °C
Index of Refraction: 1.567
Molar Refractivity: 102.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): -0.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.37
Polar Surface Area: 27 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 46.8±3.0 dyne/cm
Molar Volume: 313.5±3.0 cm3

Click to predict properties on the Chemicalize site


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