ChemSpider 2D Image | 2,2'-{1,2-Ethanediylbis[(5-bromo-2-hydroxybenzyl)imino]}diacetic acid | C20H22Br2N2O6

2,2'-{1,2-Ethanediylbis[(5-bromo-2-hydroxybenzyl)imino]}diacetic acid

  • Molecular FormulaC20H22Br2N2O6
  • Average mass546.206 Da
  • Monoisotopic mass543.984436 Da
  • ChemSpider ID111219

More details:

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

2,2'-{1,2-Ethandiylbis[(5-brom-2-hydroxybenzyl)imino]}diessigsäure [German] [ACD/IUPAC Name]
2,2'-{1,2-Ethanediylbis[(5-bromo-2-hydroxybenzyl)imino]}diacetic acid [ACD/IUPAC Name]
Acide 2,2'-{1,2-éthanediylbis[(5-bromo-2-hydroxybenzyl)imino]}diacétique [French] [ACD/IUPAC Name]
2,2'-{ethane-1,2-diylbis[(5-bromo-2-hydroxybenzyl)imino]}diacetic acid(non-preferred name)
5-Br-Hbed
92830-04-1 [RN]
CID 124920
Glycine, N,N'-1,2-ethanediylbis(N-((5-bromo-2-hydroxyphenyl)methyl)-, (SP-4-2)-
N,N'-bis(5-bromo-2-hydroxybenzyl)ethylenediamine diacetic acid

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

Density: 1.7±0.1 g/cm3
Boiling Point: 684.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 105.4±3.0 kJ/mol
Flash Point: 367.8±31.5 °C
Index of Refraction: 1.671
Molar Refractivity: 117.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.45
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.35
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 122 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 73.0±3.0 dyne/cm
Molar Volume: 315.0±3.0 cm3

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