ChemSpider 2D Image | 2-Amino-3,3-dihydroxy-2-propen-1-yl 3-[(7,7-dihydroxy-6-hepten-1-yl)oxy]-2-hydroxypropyl hydrogen phosphate | C13H26NO10P

2-Amino-3,3-dihydroxy-2-propen-1-yl 3-[(7,7-dihydroxy-6-hepten-1-yl)oxy]-2-hydroxypropyl hydrogen phosphate

  • Molecular FormulaC13H26NO10P
  • Average mass387.320 Da
  • Monoisotopic mass387.129425 Da
  • ChemSpider ID95654222

More details:

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

2-Amino-3,3-dihydroxy-2-propen-1-yl 3-[(7,7-dihydroxy-6-hepten-1-yl)oxy]-2-hydroxypropyl hydrogen phosphate [ACD/IUPAC Name]
2-Amino-3,3-dihydroxy-2-propen-1-yl-3-[(7,7-dihydroxy-6-hepten-1-yl)oxy]-2-hydroxypropylhydrogenphosphat [German] [ACD/IUPAC Name]
Hydrogénophosphate de 2-amino-3,3-dihydroxy-2-propén-1-yle et de 3-[(7,7-dihydroxy-6-heptén-1-yl)oxy]-2-hydroxypropyle [French] [ACD/IUPAC Name]
Phosphoric acid, 2-amino-3,3-dihydroxy-2-propen-1-yl 3-[(7,7-dihydroxy-6-hepten-1-yl)oxy]-2-hydroxypropyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 715.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.2 mmHg at 25°C
Enthalpy of Vaporization: 119.4±6.0 kJ/mol
Flash Point: 386.4±35.7 °C
Index of Refraction: 1.576
Molar Refractivity: 86.7±0.3 cm3
#H bond acceptors: 11
#H bond donors: 8
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 0.71
ACD/LogD (pH 5.5): -4.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 74.6±3.0 dyne/cm
Molar Volume: 262.1±3.0 cm3

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