ChemSpider 2D Image | 3-[(5-Carboxy-1-methyl-1H-pyrrol-3-yl)sulfonyl]-1,2-triazadien-2-ium-1-ide | C6H6N4O4S

3-[(5-Carboxy-1-methyl-1H-pyrrol-3-yl)sulfonyl]-1,2-triazadien-2-ium-1-ide

  • Molecular FormulaC6H6N4O4S
  • Average mass230.201 Da
  • Monoisotopic mass230.010971 Da
  • ChemSpider ID75072023

More details:

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

1,2-Triazadien-2-ium-1-ide, 3-[(5-carboxy-1-methyl-1H-pyrrol-3-yl)sulfonyl]- [ACD/Index Name]
3-[(5-Carboxy-1-methyl-1H-pyrrol-3-yl)sulfonyl]-1,2-triazadien-2-ium-1-id [German] [ACD/IUPAC Name]
3-[(5-Carboxy-1-methyl-1H-pyrrol-3-yl)sulfonyl]-1,2-triazadien-2-ium-1-ide [ACD/IUPAC Name]
3-[(5-Carboxy-1-méthyl-1H-pyrrol-3-yl)sulfonyl]-1,2-triazadién-2-ium-1-ide [French] [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: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.84
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 97 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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