ChemSpider 2D Image | 2-Amino-5-({3-({2-[(4-amino-4-carboxybutanoyl)amino]-3-[(carboxylatomethyl)amino]-3-oxopropyl}disulfanyl)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoate | C20H30N6O12S2

2-Amino-5-({3-({2-[(4-amino-4-carboxybutanoyl)amino]-3-[(carboxylatomethyl)amino]-3-oxopropyl}disulfanyl)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoate

  • Molecular FormulaC20H30N6O12S2
  • Average mass610.616 Da
  • Monoisotopic mass610.137390 Da
  • ChemSpider ID3874229

  • Charge - Charge

More details:

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

2-Amino-5-({3-({2-[(4-amino-4-carboxybutanoyl)amino]-3-[(carboxylatomethyl)amino]-3-oxopropyl}disulfanyl)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoat [German] [ACD/IUPAC Name]
2-Amino-5-({3-({2-[(4-amino-4-carboxybutanoyl)amino]-3-[(carboxylatomethyl)amino]-3-oxopropyl}disulfanyl)-1-[(carboxymethyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoate [ACD/IUPAC Name]
2-Amino-5-({3-({2-[(4-amino-4-carboxybutanoyl)amino]-3-[(carboxylatométhyl)amino]-3-oxopropyl}disulfanyl)-1-[(carboxyméthyl)amino]-1-oxo-2-propanyl}amino)-5-oxopentanoate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 1196.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 191.9±6.0 kJ/mol
Flash Point: 677.4±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 18
#H bond donors: 12
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: -0.94
ACD/LogD (pH 5.5): -7.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 374 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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