ChemSpider 2D Image | 4-[(2S)-2-Amino-2-carboxyethoxy]-4-oxobutanoic acid | C7H11NO6

4-[(2S)-2-Amino-2-carboxyethoxy]-4-oxobutanoic acid

  • Molecular FormulaC7H11NO6
  • Average mass205.165 Da
  • Monoisotopic mass205.058640 Da
  • ChemSpider ID64808712

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-[(2S)-2-Amino-2-carboxyethoxy]-4-oxobutanoic acid [ACD/IUPAC Name]
4-[(2S)-2-Amino-2-carboxyethoxy]-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide 4-[(2S)-2-amino-2-carboxyéthoxy]-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanedioic acid, mono[(2S)-2-amino-2-carboxyethyl] ester [ACD/Index Name]
O-succinyl-L-serine
O-succinylserine
Ser(Suc)OH
  • Miscellaneous

    • Chemical Class:

      A dicarboxylic acid monoester obtained by formal condensation of one of the carboxy groups of succinic acid with the side-chain hydroxy group of <stereo>L</stereo>-serine. It is an intermediate in the biosynthesis of the amino acid cysteine in fungi and bacteria. ChEBI CHEBI:134286
      A dicarboxylic acid monoester obtained by formal condensation of one of the carboxy groups of succinic acid with the side-chain hydroxy group of L-serine. It is an intermediate in the biosynthesis of the amino acid cysteine in fungi and bacteria. ChEBI CHEBI:134286
      A dicarboxylic acid monoester obtained by formal condensation of one of the carboxy groups of succinic acid with the side-chain hydroxy group of L-serine. It is an intermediate in the; biosynthesis o f the amino acid cysteine in fungi and bacteria. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:134286

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

Density: 1.5±0.1 g/cm3
Boiling Point: 483.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 82.0±6.0 kJ/mol
Flash Point: 246.2±28.7 °C
Index of Refraction: 1.521
Molar Refractivity: 42.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.48
ACD/LogD (pH 5.5): -3.95
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 127 Å2
Polarizability: 17.0±0.5 10-24cm3
Surface Tension: 68.6±3.0 dyne/cm
Molar Volume: 140.9±3.0 cm3

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