ChemSpider 2D Image | 4-(2-Aminoethyl)-3,6-difluoro-1,2-benzenediol | C8H9F2NO2

4-(2-Aminoethyl)-3,6-difluoro-1,2-benzenediol

  • Molecular FormulaC8H9F2NO2
  • Average mass189.159 Da
  • Monoisotopic mass189.060135 Da
  • ChemSpider ID60763068

More details:

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

1,2-Benzenediol, 4-(2-aminoethyl)-3,6-difluoro- [ACD/Index Name]
4-(2-Aminoethyl)-3,6-difluor-1,2-benzoldiol [German] [ACD/IUPAC Name]
4-(2-Aminoethyl)-3,6-difluoro-1,2-benzenediol [ACD/IUPAC Name]
4-(2-Aminoéthyl)-3,6-difluoro-1,2-benzènediol [French] [ACD/IUPAC Name]
1379365-72-6 [RN]
MFCD20718818

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

Density: 1.4±0.1 g/cm3
Boiling Point: 303.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.6±3.0 kJ/mol
Flash Point: 137.5±26.5 °C
Index of Refraction: 1.571
Molar Refractivity: 43.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.44
ACD/LogD (pH 5.5): -1.55
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.48
Polar Surface Area: 66 Å2
Polarizability: 17.1±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 131.2±3.0 cm3

Click to predict properties on the Chemicalize site


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