ChemSpider 2D Image | N-(2-Hydroxydodecyl)-N-(2-hydroxyethyl)-β-alanine | C17H35NO4

N-(2-Hydroxydodecyl)-N-(2-hydroxyethyl)-β-alanine

  • Molecular FormulaC17H35NO4
  • Average mass317.464 Da
  • Monoisotopic mass317.256622 Da
  • ChemSpider ID21168099

More details:

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

274-643-2 [EINECS]
70521-70-9 [RN]
N-(2-Hydroxydodecyl)-N-(2-hydroxyethyl)-β-alanine
N-(2-Hydroxydodecyl)-N-(2-hydroxyethyl)-β-alanin [German] [ACD/IUPAC Name]
N-(2-Hydroxydodecyl)-N-(2-hydroxyethyl)-β-alanine [ACD/IUPAC Name]
N-(2-Hydroxydodécyl)-N-(2-hydroxyéthyl)-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-(2-hydroxydodecyl)-N-(2-hydroxyethyl)- [ACD/Index Name]
3-[(2-HYDROXYDODECYL)(2-HYDROXYETHYL)AMINO]PROPANOIC ACID

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

Density: 1.0±0.1 g/cm3
Boiling Point: 489.9±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 87.1±6.0 kJ/mol
Flash Point: 250.1±24.6 °C
Index of Refraction: 1.493
Molar Refractivity: 89.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 12.59
ACD/LogD (pH 7.4): 1.50
ACD/BCF (pH 7.4): 2.04
ACD/KOC (pH 7.4): 11.15
Polar Surface Area: 81 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 306.4±3.0 cm3

Click to predict properties on the Chemicalize site


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