ChemSpider 2D Image | 5-(2-Aminoethyl)-3-methoxy-1,2-benzenediol | C9H13NO3

5-(2-Aminoethyl)-3-methoxy-1,2-benzenediol

  • Molecular FormulaC9H13NO3
  • Average mass183.204 Da
  • Monoisotopic mass183.089539 Da
  • ChemSpider ID26492112

More details:






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

1,2-Benzenediol, 5-(2-aminoethyl)-3-methoxy- [ACD/Index Name]
5-(2-Aminoethyl)-3-methoxy-1,2-benzenediol [ACD/IUPAC Name]
5-(2-Aminoéthyl)-3-méthoxy-1,2-benzènediol [French] [ACD/IUPAC Name]
5-(2-Aminoethyl)-3-methoxy-1,2-benzoldiol [German] [ACD/IUPAC Name]
16032-86-3 [RN]
3-methoxy-4,5-dihydroxyphenethylamine
5-(2-Aminoethyl)-3-methoxybenzene-1,2-diol
MFCD08449507

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

Density: 1.2±0.1 g/cm3
Boiling Point: 374.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 180.3±26.5 °C
Index of Refraction: 1.594
Molar Refractivity: 49.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.06
ACD/LogD (pH 5.5): -3.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 146.8±3.0 cm3

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