ChemSpider 2D Image | 4-{2-[(4-Amino-2-butanyl)amino]-1-hydroxyethyl}-1,2-benzenediol | C12H20N2O3

4-{2-[(4-Amino-2-butanyl)amino]-1-hydroxyethyl}-1,2-benzenediol

  • Molecular FormulaC12H20N2O3
  • Average mass240.299 Da
  • Monoisotopic mass240.147400 Da
  • ChemSpider ID23228985

More details:

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

1,2-Benzenediol, 4-[2-[(3-amino-1-methylpropyl)amino]-1-hydroxyethyl]- [ACD/Index Name]
4-{2-[(4-Amino-2-butanyl)amino]-1-hydroxyethyl}-1,2-benzenediol [ACD/IUPAC Name]
4-{2-[(4-Amino-2-butanyl)amino]-1-hydroxyéthyl}-1,2-benzènediol [French] [ACD/IUPAC Name]
4-{2-[(4-Amino-2-butanyl)amino]-1-hydroxyethyl}-1,2-benzoldiol [German] [ACD/IUPAC Name]
4-{2-[(4-aminobutan-2-yl)amino]-1-hydroxyethyl}benzene-1,2-diol
4-[2-(3-Amino-1-methyl-propylamino)-1-hydroxy-ethyl]-benzene-1,2-diol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 473.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.6±3.0 kJ/mol
Flash Point: 240.1±27.3 °C
Index of Refraction: 1.595
Molar Refractivity: 66.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.64
ACD/LogD (pH 5.5): -4.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 99 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 196.3±3.0 cm3

Click to predict properties on the Chemicalize site


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