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Search term: GMZNJVTXGDESME (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-[(2-Hydroxyethyl)(4-iodobenzyl)amino]-1-propanol | C12H18INO2

3-[(2-Hydroxyethyl)(4-iodobenzyl)amino]-1-propanol

  • Molecular FormulaC12H18INO2
  • Average mass335.181 Da
  • Monoisotopic mass335.038208 Da
  • ChemSpider ID68018410

More details:

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

1-Propanol, 3-[(2-hydroxyethyl)[(4-iodophenyl)methyl]amino]- [ACD/Index Name]
3-[(2-Hydroxyethyl)(4-iodbenzyl)amino]-1-propanol [German] [ACD/IUPAC Name]
3-[(2-Hydroxyethyl)(4-iodobenzyl)amino]-1-propanol [ACD/IUPAC Name]
3-[(2-Hydroxyéthyl)(4-iodobenzyl)amino]-1-propanol [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 422.6±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.3±3.0 kJ/mol
Flash Point: 209.4±24.6 °C
Index of Refraction: 1.613
Molar Refractivity: 74.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.17
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.00
ACD/KOC (pH 7.4): 106.65
Polar Surface Area: 44 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 212.6±3.0 cm3

Click to predict properties on the Chemicalize site


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