ChemSpider 2D Image | 2-(2-Aminoethyl)-5-methyl-1,4-benzenediol | C9H13NO2

2-(2-Aminoethyl)-5-methyl-1,4-benzenediol

  • Molecular FormulaC9H13NO2
  • Average mass167.205 Da
  • Monoisotopic mass167.094635 Da
  • ChemSpider ID23221461

More details:






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

1,4-Benzenediol, 2-(2-aminoethyl)-5-methyl- [ACD/Index Name]
2-(2-Aminoethyl)-5-methyl-1,4-benzenediol [ACD/IUPAC Name]
2-(2-Aminoéthyl)-5-méthyl-1,4-benzènediol [French] [ACD/IUPAC Name]
2-(2-Aminoethyl)-5-methyl-1,4-benzoldiol [German] [ACD/IUPAC Name]
2-(2-aminoethyl)-5-methylbenzene-1,4-diol
2-(2-Amino-ethyl)-5-methyl-benzene-1,4-diol
81255-52-9 [RN]
MFCD20694582

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 358.1±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 170.3±26.5 °C
Index of Refraction: 1.605
Molar Refractivity: 47.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.34
ACD/LogD (pH 5.5): -2.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 66 Å2
Polarizability: 19.0±0.5 10-24cm3
Surface Tension: 56.1±3.0 dyne/cm
Molar Volume: 139.1±3.0 cm3

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