ChemSpider 2D Image | 3-Bromo-N-(2-butoxyethyl)aniline | C12H18BrNO

3-Bromo-N-(2-butoxyethyl)aniline

  • Molecular FormulaC12H18BrNO
  • Average mass272.181 Da
  • Monoisotopic mass271.057159 Da
  • ChemSpider ID28544267

More details:

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

1247147-26-7 [RN]
3-Brom-N-(2-butoxyethyl)anilin [German] [ACD/IUPAC Name]
3-Bromo-N-(2-butoxyethyl)aniline [ACD/IUPAC Name]
3-Bromo-N-(2-butoxyéthyl)aniline [French] [ACD/IUPAC Name]
Benzenamine, 3-bromo-N-(2-butoxyethyl)- [ACD/Index Name]
MFCD14677253

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

Density: 1.3±0.1 g/cm3
Boiling Point: 355.1±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.0±3.0 kJ/mol
Flash Point: 168.5±23.7 °C
Index of Refraction: 1.553
Molar Refractivity: 68.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 637.91
ACD/KOC (pH 5.5): 3530.45
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 645.21
ACD/KOC (pH 7.4): 3570.82
Polar Surface Area: 21 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 214.0±3.0 cm3

Click to predict properties on the Chemicalize site


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