ChemSpider 2D Image | (3,4,5,7-TETRAHYDROXY-HEPT-1-ENYL)-PHOSPHONIC ACID | C7H15O7P

(3,4,5,7-TETRAHYDROXY-HEPT-1-ENYL)-PHOSPHONIC ACID

  • Molecular FormulaC7H15O7P
  • Average mass242.164 Da
  • Monoisotopic mass242.055542 Da
  • ChemSpider ID20016557
  • Double-bond stereo - Double-bond stereo


More details:






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

(3,4,5,7-TETRAHYDROXY-HEPT-1-ENYL)-PHOSPHONIC ACID
[(1E)-3,4,5,7-Tetrahydroxy-1-hepten-1-yl]phosphonic acid [ACD/IUPAC Name]
[(1E)-3,4,5,7-Tetrahydroxy-1-hepten-1-yl]phosphonsäure [German] [ACD/IUPAC Name]
Acide [(1E)-3,4,5,7-tétrahydroxy-1-heptén-1-yl]phosphonique [French] [ACD/IUPAC Name]
Hept-1-enitol, 1,2,6-trideoxy-1-phosphono-, (1E)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 641.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 108.5±6.0 kJ/mol
Flash Point: 342.0±34.3 °C
Index of Refraction: 1.598
Molar Refractivity: 50.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -3.73
ACD/LogD (pH 5.5): -6.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 148 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 95.3±3.0 dyne/cm
Molar Volume: 148.0±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement