ChemSpider 2D Image | 2-O-(6-phosphono-alpha-D-mannosyl)-D-glyceric acid | C9H17O12P

2-O-(6-phosphono-α-D-mannosyl)-D-glyceric acid

  • Molecular FormulaC9H17O12P
  • Average mass348.198 Da
  • Monoisotopic mass348.045776 Da
  • ChemSpider ID26332075

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2R)-3-Hydroxy-2-[(6-O-phosphono-α-D-mannopyranosyl)oxy]propanoic acid [ACD/IUPAC Name]
(2R)-3-Hydroxy-2-[(6-O-phosphono-α-D-mannopyranosyl)oxy]propansäure [German] [ACD/IUPAC Name]
2-O-(6-phosphono-α-D-mannosyl)-D-glyceric acid
Acide (2R)-3-hydroxy-2-[(6-O-phosphono-α-D-mannopyranosyl)oxy]propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3-hydroxy-2-[(6-O-phosphono-α-D-mannopyranosyl)oxy]-, (2R)- [ACD/Index Name]
(2R)-3-hydroxy-2-{[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-[(phosphonooxy)methyl]oxan-2-yl]oxy}propanoic acid
2-O-(6-Phospho-a-mannosyl)-D-glycerate
2-O-(6-Phospho-a-mannosyl)-D-glyceric acid
2-O-(6-Phospho-α-mannosyl)-D-glycerate
2-O-(6-Phospho-α-mannosyl)-D-glyceric acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.9±0.1 g/cm3
Boiling Point: 775.9±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.7±6.0 kJ/mol
Flash Point: 423.0±35.7 °C
Index of Refraction: 1.607
Molar Refractivity: 64.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -7.40
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 213 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 111.1±5.0 dyne/cm
Molar Volume: 186.4±5.0 cm3

Click to predict properties on the Chemicalize site


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