ChemSpider 2D Image | 2-O-Methyl-1,6-di-O-phosphono-D-mannitol | C7H18O12P2

2-O-Methyl-1,6-di-O-phosphono-D-mannitol

  • Molecular FormulaC7H18O12P2
  • Average mass356.158 Da
  • Monoisotopic mass356.027344 Da
  • ChemSpider ID28508353

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-O-Methyl-1,6-di-O-phosphono-D-mannitol [German] [ACD/IUPAC Name]
2-O-Methyl-1,6-di-O-phosphono-D-mannitol [ACD/IUPAC Name]
2-O-Méthyl-1,6-di-O-phosphono-D-mannitol [French] [ACD/IUPAC Name]
D-Mannitol, 2-O-methyl-, 1,6-bis(dihydrogen phosphate) [ACD/Index Name]
5MM

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

Density: 1.8±0.1 g/cm3
Boiling Point: 734.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.3±6.0 kJ/mol
Flash Point: 397.8±35.7 °C
Index of Refraction: 1.569
Molar Refractivity: 64.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -3.32
ACD/LogD (pH 5.5): -8.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 223 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 101.5±3.0 dyne/cm
Molar Volume: 195.5±3.0 cm3

Click to predict properties on the Chemicalize site


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