ChemSpider 2D Image | 1-S-{[5-(Methylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose | C12H23NO10S3

1-S-{[5-(Methylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose

  • Molecular FormulaC12H23NO10S3
  • Average mass437.507 Da
  • Monoisotopic mass437.048401 Da
  • ChemSpider ID21172823

More details:






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

1-S-{[5-(Methylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose [ACD/IUPAC Name]
1-S-{[5-(Methylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose [German] [ACD/IUPAC Name]
1-S-{[5-(Méthylsulfanyl)pentanoyl](sulfooxy)amino}-1-thiohexopyranose [French] [ACD/IUPAC Name]
21973-56-8 [RN]
244-689-8 [EINECS]
Hexopyranose, 1-S-[[5-(methylthio)-1-oxopentyl](sulfooxy)amino]-1-thio- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.651
Molar Refractivity: 95.5±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 0.83
ACD/LogD (pH 5.5): -4.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 233 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 93.5±5.0 dyne/cm
Molar Volume: 261.3±5.0 cm3

Click to predict properties on the Chemicalize site






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