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Search term: C\C(=N/CCSC[C@H](N)C(O)=O)C(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | S-{2-[(E)-(1-Carboxyethylidene)amino]ethyl}-L-cysteine | C8H14N2O4S

S-{2-[(E)-(1-Carboxyethylidene)amino]ethyl}-L-cysteine

  • Molecular FormulaC8H14N2O4S
  • Average mass234.273 Da
  • Monoisotopic mass234.067429 Da
  • ChemSpider ID59053856

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Cysteine, S-[2-[[(1E)-1-carboxyethylidene]amino]ethyl]- [ACD/Index Name]
S-{2-[(E)-(1-Carboxyethyliden)amino]ethyl}-L-cystein [German] [ACD/IUPAC Name]
S-{2-[(E)-(1-Carboxyethylidene)amino]ethyl}-L-cysteine [ACD/IUPAC Name]
S-{2-[(E)-(1-Carboxyéthylidène)amino]éthyl}-L-cystéine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 464.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 79.5±6.0 kJ/mol
Flash Point: 234.4±31.5 °C
Index of Refraction: 1.584
Molar Refractivity: 55.4±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: -0.11
ACD/LogD (pH 5.5): -2.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 138 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 56.8±7.0 dyne/cm
Molar Volume: 165.7±7.0 cm3

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