ChemSpider 2D Image | 5-({(2R)-1-[(Carboxylatomethyl)amino]-1-oxo-3-sulfanyl-2-propanyl}amino)-2,5-dioxopentanoatato(3-) | C10H12N2O7S

5-({(2R)-1-[(Carboxylatomethyl)amino]-1-oxo-3-sulfanyl-2-propanyl}amino)-2,5-dioxopentanoatato(3-)

  • Molecular FormulaC10H12N2O7S
  • Average mass304.278 Da
  • Monoisotopic mass304.037628 Da
  • ChemSpider ID76963034

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

5-({(2R)-1-[(Carboxylatomethyl)amino]-1-oxo-3-sulfanyl-2-propanyl}amino)-2,5-dioxopentanoat [German] [ACD/IUPAC Name]
5-({(2R)-1-[(Carboxylatomethyl)amino]-1-oxo-3-sulfanyl-2-propanyl}amino)-2,5-dioxopentanoatato(3-) [ACD/IUPAC Name]
5-({(2R)-1-[(Carboxylatométhyl)amino]-1-oxo-3-sulfanyl-2-propanyl}amino)-2,5-dioxopentanoate [French] [ACD/IUPAC Name]
Glycinato(2-), N-(4-carboxy-1,4-dioxobutyl)-L-cysteinyl-, ion(2-) [ACD/Index Name]
5-({(2R)-1-[(carboxylatomethyl)amino]-1-oxo-3-sulfanylpropan-2-yl}amino)-2,5-dioxopentanoate
N-(4-oxoglutaryl)-L-cysteinylglycine

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

Density:
Boiling Point: 726.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 115.4±6.0 kJ/mol
Flash Point: 393.0±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: -1.51
ACD/LogD (pH 5.5): -6.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 194 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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