ChemSpider 2D Image | N-[(5S)-5-Ammonio-5-carboxylatopentanoyl]-L-cysteinyl(2,3,4,4,4,4',4',4'-~2~H_8_)valine | C14H17D8N3O6S

N-[(5S)-5-Ammonio-5-carboxylatopentanoyl]-L-cysteinyl(2,3,4,4,4,4',4',4'-2H8)valine

  • Molecular FormulaC14H17D8N3O6S
  • Average mass371.479 Da
  • Monoisotopic mass371.196625 Da
  • ChemSpider ID30902945

  • defined stereocentres - 2 of 3 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

N-[(5S)-5-Ammonio-5-carboxylatopentanoyl]-L-cysteinyl(2,3,4,4,4,4',4',4'-2H8)valin [German] [ACD/IUPAC Name]
N-[(5S)-5-Ammonio-5-carboxylatopentanoyl]-L-cysteinyl(2,3,4,4,4,4',4',4'-2H8)valine [ACD/IUPAC Name]
N-[(5S)-5-Ammonio-5-carboxylatopentanoyl]-L-cystéinyl(2,3,4,4,4,4',4',4'-2H8)valine [French] [ACD/IUPAC Name]
Valine-2,3,4,4,4,4',4',4'-d8, N-[(5S)-5-amino-5-carboxy-1-oxopentyl]-L-cysteinyl- [ACD/Index Name]

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

Density:
Boiling Point: 718.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 114.3±6.0 kJ/mol
Flash Point: 388.1±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 0.56
ACD/LogD (pH 5.5): -2.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.94
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 202 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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