ChemSpider 2D Image | (3aR,4R,5S,6S,7R,7aS)-4,5,6,7-Tetrahydroxyhexahydro-1,3,2-benzodioxaphosphol-2-olate 2-oxide | C6H10O8P

(3aR,4R,5S,6S,7R,7aS)-4,5,6,7-Tetrahydroxyhexahydro-1,3,2-benzodioxaphosphol-2-olate 2-oxide

  • Molecular FormulaC6H10O8P
  • Average mass241.113 Da
  • Monoisotopic mass241.011871 Da
  • ChemSpider ID26331201

  • Charge - Charge

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3aR,4R,5S,6S,7R,7aS) 2-Oxyde de 4,5,6,7-tétrahydroxyhexahydro-1,3,2-benzodioxaphosphol-2-olate [French] [ACD/IUPAC Name]
(3aR,4R,5S,6S,7R,7aS)-4,5,6,7-Tetrahydroxyhexahydro-1,3,2-benzodioxaphosphol-2-olat-2-oxid [German] [ACD/IUPAC Name]
(3aR,4R,5S,6S,7R,7aS)-4,5,6,7-Tetrahydroxyhexahydro-1,3,2-benzodioxaphosphol-2-olate 2-oxide [ACD/IUPAC Name]
1,3,2-Benzodioxaphosphole-4,5,6,7-tetrol, hexahydro-2-hydroxy-, ion(1-), 2-oxide, (3aR,4R,5S,6S,7R,7aS)- [ACD/Index Name]
1D-myo-Inositol 1,2-cyclic phosphate
1D-myo-inositol 1,2-cyclic phosphate(1-)
1D-myo-inositol 1,2-phosphate
D-myo-Inositol 1,2-cyclic phosphate

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

5082175 [DBID]

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

Density:
Boiling Point: 436.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±6.0 kJ/mol
Flash Point: 218.0±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 0
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 149 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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