ChemSpider 2D Image | 89A0HNR42S | C11H16BrNO3

89A0HNR42S

  • Molecular FormulaC11H16BrNO3
  • Average mass290.154 Da
  • Monoisotopic mass289.031342 Da
  • ChemSpider ID21106261

More details:






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

2-(4-Brom-2,5-dimethoxyphenyl)-2-methoxyethanamin [German] [ACD/IUPAC Name]
2-(4-Bromo-2,5-dimethoxyphenyl)-2-methoxyethanamine [ACD/IUPAC Name]
2-(4-Bromo-2,5-diméthoxyphényl)-2-méthoxyéthanamine [French] [ACD/IUPAC Name]
2,5,?-trimethoxy-4-bromophenethylamine
2,5,β-TRIMETHOXY-4-BROMOPHENETHYLAMINE
89A0HNR42S
98537-42-9 [RN]
Benzeneethanamine, 4-bromo-β,2,5-trimethoxy- [ACD/Index Name]
UNII:89A0HNR42S
2-(4-Bromo-2,5-dimethoxyphenyl)-2-methoxyethan-1-amine
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 376.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.4±3.0 kJ/mol
Flash Point: 181.5±27.9 °C
Index of Refraction: 1.537
Molar Refractivity: 66.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.97
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.75
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 7.61
ACD/KOC (pH 7.4): 116.72
Polar Surface Area: 54 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 213.7±3.0 cm3

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