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ChemSpider 2D Image | (1R,2S,3R,4S,5S,6S)-2,3,4,5,6-Pentahydroxycyclohexyl phosphate | C6H11O9P

(1R,2S,3R,4S,5S,6S)-2,3,4,5,6-Pentahydroxycyclohexyl phosphate

  • Molecular FormulaC6H11O9P
  • Average mass258.121 Da
  • Monoisotopic mass258.015167 Da
  • ChemSpider ID16744087

  • Charge - Charge

    defined stereocentres - 6 of 6 defined stereocentres

More details:

Date of deprecation: 14:52, May 21, 2015
Reason for deprecation: Deprecate record: there are no supporting data sources.

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

(1R,2S,3R,4S,5S,6S)-2,3,4,5,6-Pentahydroxycyclohexyl phosphate [ACD/IUPAC Name]
(1R,2S,3R,4S,5S,6S)-2,3,4,5,6-Pentahydroxycyclohexylphosphat [German] [ACD/IUPAC Name]
1,2,3,4,5,6-Cyclohexanehexol, 1-(dihydrogen phosphate), ion(2-), (1α,2α,3α,4α,5α,6β)- [ACD/Index Name]
Phosphate de (1R,2S,3R,4S,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyle [French] [ACD/IUPAC Name]

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

LI7 [DBID]

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

Density:
Boiling Point: 517.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 90.9±6.0 kJ/mol
Flash Point: 266.7±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.40
ACD/LogD (pH 5.5): -6.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 183 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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