ChemSpider 2D Image | (2S)-2,2'-Iminodisuccinic acid (non-preferred name) | C8H11NO8

(2S)-2,2'-Iminodisuccinic acid (non-preferred name)

  • Molecular FormulaC8H11NO8
  • Average mass249.175 Da
  • Monoisotopic mass249.048462 Da
  • ChemSpider ID57367258

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2S)-2,2'-Iminodibernsteinsäure (non-preferred name) [German] [ACD/IUPAC Name]
(2S)-2,2'-Iminodisuccinic acid (non-preferred name) [ACD/IUPAC Name]
Acide (2S)-2,2'-iminodisuccinique (non-preferred name) [French] [ACD/IUPAC Name]
(2S)-2,2'-Azanediyldisuccinic acid
(2S)-2-[(1,2-Dicarboxyethyl)amino]butanedioic acid (non-preferred name)
7408-20-0 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 465.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 79.7±6.0 kJ/mol
Flash Point: 235.4±28.7 °C
Index of Refraction: 1.572
Molar Refractivity: 48.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 0.00
ACD/LogD (pH 5.5): -6.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 161 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 91.9±3.0 dyne/cm
Molar Volume: 148.7±3.0 cm3

Click to predict properties on the Chemicalize site


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