ChemSpider 2D Image | (3Z)-3-({(2Z)-2-[(2,2-Dihydroxyvinyl)imino]-3,3-dihydroxypropyl}imino)-4,4-dihydroxybutanoic acid | C9H14N2O8

(3Z)-3-({(2Z)-2-[(2,2-Dihydroxyvinyl)imino]-3,3-dihydroxypropyl}imino)-4,4-dihydroxybutanoic acid

  • Molecular FormulaC9H14N2O8
  • Average mass278.216 Da
  • Monoisotopic mass278.075012 Da
  • ChemSpider ID95719047

  • Double-bond stereo - Double-bond stereo

More details:

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

(3Z)-3-({(2Z)-2-[(2,2-Dihydroxyvinyl)imino]-3,3-dihydroxypropyl}imino)-4,4-dihydroxybutanoic acid [ACD/IUPAC Name]
(3Z)-3-({(2Z)-2-[(2,2-Dihydroxyvinyl)imino]-3,3-dihydroxypropyl}imino)-4,4-dihydroxybutansäure [German] [ACD/IUPAC Name]
Acide (3Z)-3-({(2Z)-2-[(2,2-dihydroxyvinyl)imino]-3,3-dihydroxypropyl}imino)-4,4-dihydroxybutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-[[(2Z)-2-[(2,2-dihydroxyethenyl)imino]-3,3-dihydroxypropyl]imino]-4,4-dihydroxy-, (3Z)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 514.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.5±6.0 kJ/mol
Flash Point: 265.0±30.1 °C
Index of Refraction: 1.605
Molar Refractivity: 56.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -2.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 183 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 75.2±7.0 dyne/cm
Molar Volume: 165.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement