ChemSpider 2D Image | 2-[(Z)-{[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]iminio}methyl]-6-hydroxyphenolate | C11H15NO5

2-[(Z)-{[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]iminio}methyl]-6-hydroxyphenolate

  • Molecular FormulaC11H15NO5
  • Average mass241.240 Da
  • Monoisotopic mass241.095016 Da
  • ChemSpider ID30652375

  • Double-bond stereo - Double-bond stereo

More details:

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

1,2-Benzenediol, 3-[(Z)-[[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]imino]methyl]- [ACD/Index Name]
2-[(Z)-{[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]iminio}methyl]-6-hydroxyphenolat [German] [ACD/IUPAC Name]
2-[(Z)-{[1,3-Dihydroxy-2-(hydroxymethyl)-2-propanyl]iminio}methyl]-6-hydroxyphenolate [ACD/IUPAC Name]
2-[(Z)-{[1,3-Dihydroxy-2-(hydroxyméthyl)-2-propanyl]iminio}méthyl]-6-hydroxyphénolate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 586.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 399.6±19.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 0.69
ACD/LogD (pH 5.5): -0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.76
ACD/LogD (pH 7.4): -0.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.60
Polar Surface Area: 118 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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