ChemSpider 2D Image | 1-[(2-Fluoro-3-methoxybenzyl)amino]-2-butanol | C12H18FNO2

1-[(2-Fluoro-3-methoxybenzyl)amino]-2-butanol

  • Molecular FormulaC12H18FNO2
  • Average mass227.275 Da
  • Monoisotopic mass227.132156 Da
  • ChemSpider ID42235188

More details:

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

1-[(2-Fluor-3-methoxybenzyl)amino]-2-butanol [German] [ACD/IUPAC Name]
1-[(2-Fluoro-3-methoxybenzyl)amino]-2-butanol [ACD/IUPAC Name]
1-[(2-Fluoro-3-méthoxybenzyl)amino]-2-butanol [French] [ACD/IUPAC Name]
2-Butanol, 1-[[(2-fluoro-3-methoxyphenyl)methyl]amino]- [ACD/Index Name]
1-{[(2-FLUORO-3-METHOXYPHENYL)METHYL]AMINO}BUTAN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 352.9±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 63.1±3.0 kJ/mol
Flash Point: 167.2±25.1 °C
Index of Refraction: 1.507
Molar Refractivity: 61.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): -0.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.01
ACD/BCF (pH 7.4): 2.26
ACD/KOC (pH 7.4): 37.60
Polar Surface Area: 41 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 206.7±3.0 cm3

Click to predict properties on the Chemicalize site


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