ChemSpider 2D Image | 4-({3-[(5-Carboxy-2-chlorophenyl)amino]-3-oxopropyl}sulfanyl)-3-methyl-1,2,3-oxadiazol-3-ium-5-olate | C13H12ClN3O5S

4-({3-[(5-Carboxy-2-chlorophenyl)amino]-3-oxopropyl}sulfanyl)-3-methyl-1,2,3-oxadiazol-3-ium-5-olate

  • Molecular FormulaC13H12ClN3O5S
  • Average mass357.770 Da
  • Monoisotopic mass357.018616 Da
  • ChemSpider ID28609698

More details:

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

1,2,3-Oxadiazolium, 4-[[3-[(5-carboxy-2-chlorophenyl)amino]-3-oxopropyl]thio]-5-hydroxy-3-methyl-, inner salt [ACD/Index Name]
4-({3-[(5-Carboxy-2-chlorophenyl)amino]-3-oxopropyl}sulfanyl)-3-methyl-1,2,3-oxadiazol-3-ium-5-olate [ACD/IUPAC Name]
4-({3-[(5-Carboxy-2-chlorophényl)amino]-3-oxopropyl}sulfanyl)-3-méthyl-1,2,3-oxadiazol-3-ium-5-olate [French] [ACD/IUPAC Name]
4-({3-[(5-Carboxy-2-chlorphenyl)amino]-3-oxopropyl}sulfanyl)-3-methyl-1,2,3-oxadiazol-3-ium-5-olat [German] [ACD/IUPAC Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 145 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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