ChemSpider 2D Image | (1S,7S,7aR)-7-(Hydroxymethyl)hexahydro-1H-pyrrolizin-1-ol | C8H15NO2

(1S,7S,7aR)-7-(Hydroxymethyl)hexahydro-1H-pyrrolizin-1-ol

  • Molecular FormulaC8H15NO2
  • Average mass157.210 Da
  • Monoisotopic mass157.110275 Da
  • ChemSpider ID110543718

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(1S,7S,7aR)-7-(Hydroxymethyl)hexahydro-1H-pyrrolizin-1-ol [ACD/IUPAC Name]
(1S,7S,7aR)-7-(Hydroxymethyl)hexahydro-1H-pyrrolizin-1-ol [German] [ACD/IUPAC Name]
(1S,7S,7aR)-7-(Hydroxyméthyl)hexahydro-1H-pyrrolizin-1-ol [French] [ACD/IUPAC Name]
1H-Pyrrolizine-1-methanol, hexahydro-7-hydroxy-, (1S,7S,7aR)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 261.9±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.0±6.0 kJ/mol
Flash Point: 131.3±20.4 °C
Index of Refraction: 1.573
Molar Refractivity: 41.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.00
ACD/LogD (pH 5.5): -3.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 44 Å2
Polarizability: 16.6±0.5 10-24cm3
Surface Tension: 54.6±5.0 dyne/cm
Molar Volume: 127.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement