ChemSpider 2D Image | Methyl 5-(2-chloro-1-{[(1-methyl-4-propyl-2-pyrrolidiniumyl)carbonyl]amino}propyl)-2-O-(hydroxyphosphinato)-1-thiopentopyranoside | C18H34ClN2O8PS

Methyl 5-(2-chloro-1-{[(1-methyl-4-propyl-2-pyrrolidiniumyl)carbonyl]amino}propyl)-2-O-(hydroxyphosphinato)-1-thiopentopyranoside

  • Molecular FormulaC18H34ClN2O8PS
  • Average mass504.963 Da
  • Monoisotopic mass504.146210 Da
  • ChemSpider ID21235236

More details:

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

5-(2-Chloro-1-{[(1-méthyl-4-propyl-2-pyrrolidiniumyl)carbonyl]amino}propyl)-2-O-(hydroxyphosphinato)-1-thiopentopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 5-(2-chloro-1-{[(1-methyl-4-propyl-2-pyrrolidiniumyl)carbonyl]amino}propyl)-2-O-(hydroxyphosphinato)-1-thiopentopyranoside [ACD/IUPAC Name]
Methyl-5-(2-chlor-1-{[(1-methyl-4-propyl-2-pyrrolidiniumyl)carbonyl]amino}propyl)-2-O-(hydroxyphosphinato)-1-thiopentopyranosid [German] [ACD/IUPAC Name]
Octopyranoside, methyl 7-chloro-6,7,8-trideoxy-6-[[(1-methyl-4-propyl-2-pyrrolidinyl)carbonyl]amino]-1-thio-, 2-(dihydrogen phosphate) [ACD/Index Name]

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

Density:
Boiling Point: 704.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 117.8±6.0 kJ/mol
Flash Point: 379.8±35.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 1.89
ACD/LogD (pH 5.5): -1.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.33
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 191 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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