ChemSpider 2D Image | 2-{[(2-aminoethyl)amino]methyl}-4-tert-butyl-6-iodophenol | C13H21IN2O

2-{[(2-aminoethyl)amino]methyl}-4-tert-butyl-6-iodophenol

  • Molecular FormulaC13H21IN2O
  • Average mass348.223 Da
  • Monoisotopic mass348.069855 Da
  • ChemSpider ID23233734

More details:

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

2-{[(2-aminoethyl)amino]methyl}-4-tert-butyl-6-iodophenol
2-{[(2-Aminoethyl)amino]methyl}-6-iod-4-(2-methyl-2-propanyl)phenol [German] [ACD/IUPAC Name]
2-{[(2-Aminoethyl)amino]methyl}-6-iodo-4-(2-methyl-2-propanyl)phenol [ACD/IUPAC Name]
2-{[(2-Aminoéthyl)amino]méthyl}-6-iodo-4-(2-méthyl-2-propanyl)phénol [French] [ACD/IUPAC Name]
Phenol, 2-[[(2-aminoethyl)amino]methyl]-4-(1,1-dimethylethyl)-6-iodo- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 371.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.2±3.0 kJ/mol
Flash Point: 178.2±27.9 °C
Index of Refraction: 1.592
Molar Refractivity: 80.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.68
Polar Surface Area: 58 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 45.5±3.0 dyne/cm
Molar Volume: 238.4±3.0 cm3

Click to predict properties on the Chemicalize site


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