ChemSpider 2D Image | (3R)-3,4,4-Trimethyl-1-[2-methyl-2-(1-piperidinyl)propyl]-3-pyrrolidinol | C16H32N2O

(3R)-3,4,4-Trimethyl-1-[2-methyl-2-(1-piperidinyl)propyl]-3-pyrrolidinol

  • Molecular FormulaC16H32N2O
  • Average mass268.438 Da
  • Monoisotopic mass268.251465 Da
  • ChemSpider ID29439854
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3R)-3,4,4-Trimethyl-1-[2-methyl-2-(1-piperidinyl)propyl]-3-pyrrolidinol [German] [ACD/IUPAC Name]
(3R)-3,4,4-Trimethyl-1-[2-methyl-2-(1-piperidinyl)propyl]-3-pyrrolidinol [ACD/IUPAC Name]
(3R)-3,4,4-Triméthyl-1-[2-méthyl-2-(1-pipéridinyl)propyl]-3-pyrrolidinol [French] [ACD/IUPAC Name]
3-Pyrrolidinol, 3,4,4-trimethyl-1-[2-methyl-2-(1-piperidinyl)propyl]-, (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: 340.3±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 67.6±6.0 kJ/mol
Flash Point: 125.7±22.4 °C
Index of Refraction: 1.500
Molar Refractivity: 80.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): -0.73
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.11
Polar Surface Area: 27 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 273.4±3.0 cm3

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