ChemSpider 2D Image | 5'-S-[(3S)-3-Amino-3-carboxylatopropyl]-5'-thioadenosine | C14H19N6O5S

5'-S-[(3S)-3-Amino-3-carboxylatopropyl]-5'-thioadenosine

  • Molecular FormulaC14H19N6O5S
  • Average mass383.403 Da
  • Monoisotopic mass383.114319 Da
  • ChemSpider ID28533096

  • Charge - Charge

    defined stereocentres - 5 of 5 defined stereocentres

More details:

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

5'-S-[(3S)-3-Amino-3-carboxylatopropyl]-5'-thioadenosin [German] [ACD/IUPAC Name]
5'-S-[(3S)-3-Amino-3-carboxylatopropyl]-5'-thioadenosine [ACD/IUPAC Name]
5'-S-[(3S)-3-Amino-3-carboxylatopropyl]-5'-thioadénosine [French] [ACD/IUPAC Name]
Adenosine, 5'-S-[(3S)-3-amino-3-carboxypropyl]-5'-thio-, ion(1-) [ACD/Index Name]
S-adenosyl-L-homocysteinate
  • Miscellaneous

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

Density:
Boiling Point: 787.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.1±3.0 kJ/mol
Flash Point: 430.0±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.15
ACD/LogD (pH 5.5): -3.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 211 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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