ChemSpider 2D Image | (3aR,6aS)Octahydrophospholo[3,4-c]pyrrol-5-ol 5-oxide | C6H12NO2P

(3aR,6aS)Octahydrophospholo[3,4-c]pyrrol-5-ol 5-oxide

  • Molecular FormulaC6H12NO2P
  • Average mass161.139 Da
  • Monoisotopic mass161.060562 Da
  • ChemSpider ID61485588

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3aR,6aS) 5-Oxyde de octahydrophospholo[3,4-c]pyrrol-5-ol [French] [ACD/IUPAC Name]
(3aR,6aS)Octahydrophospholo[3,4-c]pyrrol-5-ol 5-oxide [ACD/IUPAC Name]
(3aR,6aS)Octahydrophospholo[3,4-c]pyrrol-5-ol-5-oxid [German] [ACD/IUPAC Name]
Phospholo[3,4-c]pyrrole, octahydro-5-hydroxy-, 5-oxide, (3aR,6aS)- [ACD/Index Name]
875138-28-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 438.0±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±6.0 kJ/mol
Flash Point: 218.7±25.7 °C
Index of Refraction: 1.523
Molar Refractivity: 37.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.82
ACD/LogD (pH 5.5): -3.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 59 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 123.1±5.0 cm3

Click to predict properties on the Chemicalize site


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