ChemSpider 2D Image | 2,2'-[(1,4-Dioxo-1,4-butanediyl)diimino]diacetic acid | C8H12N2O6

2,2'-[(1,4-Dioxo-1,4-butanediyl)diimino]diacetic acid

  • Molecular FormulaC8H12N2O6
  • Average mass232.191 Da
  • Monoisotopic mass232.069534 Da
  • ChemSpider ID21249377

More details:






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

2,2'-[(1,4-Dioxo-1,4-butandiyl)diimino]diessigsäure [German] [ACD/IUPAC Name]
2,2'-[(1,4-Dioxo-1,4-butanediyl)diimino]diacetic acid [ACD/IUPAC Name]
Acide 2,2'-[(1,4-dioxo-1,4-butanediyl)diimino]diacétique [French] [ACD/IUPAC Name]
[3-(CARBOXYMETHYLCARBAMOYL)PROPANAMIDO]ACETIC ACID
102817-61-8 [RN]
2-{3-[(CARBOXYMETHYL)CARBAMOYL]PROPANAMIDO}ACETIC ACID
Glycine, N,N'-(1,4-dioxo-1,4-butanediyl)bis-
Succinylglycine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 742.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.3 mmHg at 25°C
Enthalpy of Vaporization: 117.9±6.0 kJ/mol
Flash Point: 403.1±31.5 °C
Index of Refraction: 1.524
Molar Refractivity: 49.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -2.73
ACD/LogD (pH 5.5): -6.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.89
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 133 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 161.7±3.0 cm3

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