ChemSpider 2D Image | 25C-NBOH | C17H20ClNO3

25C-NBOH

  • Molecular FormulaC17H20ClNO3
  • Average mass321.799 Da
  • Monoisotopic mass321.113159 Da
  • ChemSpider ID58191432

More details:






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

1391488-16-6 [RN]
2-({[2-(4-Chlor-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol [German] [ACD/IUPAC Name]
2-({[2-(4-Chloro-2,5-dimethoxyphenyl)ethyl]amino}methyl)phenol [ACD/IUPAC Name]
2-({[2-(4-Chloro-2,5-diméthoxyphényl)éthyl]amino}méthyl)phénol [French] [ACD/IUPAC Name]
25C-NBOH [Wiki]
Phenol, 2-[[[2-(4-chloro-2,5-dimethoxyphenyl)ethyl]amino]methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 465.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 235.6±27.3 °C
Index of Refraction: 1.579
Molar Refractivity: 88.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 8.08
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 66.63
ACD/KOC (pH 7.4): 344.62
Polar Surface Area: 51 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 266.7±3.0 cm3

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