ChemSpider 2D Image | 2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-ethanediyl)]}disuccinic acid | C34H59NO13

2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-ethanediyl)]}disuccinic acid

  • Molecular FormulaC34H59NO13
  • Average mass689.831 Da
  • Monoisotopic mass689.398621 Da
  • ChemSpider ID26502521

More details:

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

1,2,3-Propanetricarboxylic acid, 3,3'-[1-(12-amino-11-hydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl] ester [ACD/Index Name]
1,2,3-Propanetricarboxylic acid, 1,1'-[1-(12-amino-11-hydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl] ester [ACD/Index Name]
2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosandiyl)bis[oxy(2-oxo-2,1-ethandiyl)]}dibernsteinsäure [German] [ACD/IUPAC Name]
2,2'-{(19-Amino-18-hydroxy-5,9-dimethyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-ethanediyl)]}disuccinic acid [ACD/IUPAC Name]
2-[2-({19-amino-6-[(3,4-dicarboxybutanoyl)oxy]-18-hydroxy-5,9-dimethylicosan-7-yl}oxy)-2-oxoethyl]butanedioic acid
Acide 2,2'-{(19-amino-18-hydroxy-5,9-diméthyl-6,7-icosanediyl)bis[oxy(2-oxo-2,1-éthanediyl)]}disuccinique [French] [ACD/IUPAC Name]
Fumonisin B4

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

Density: 1.2±0.1 g/cm3
Boiling Point: 821.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.8±6.0 kJ/mol
Flash Point: 450.4±34.3 °C
Index of Refraction: 1.513
Molar Refractivity: 174.1±0.3 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 33
#Rule of 5 Violations: 4
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.21
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 248 Å2
Polarizability: 69.0±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 579.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement