ChemSpider 2D Image | 2-Amino-5-[(Z)-(4-amino-3-sulfonatophenyl)(4-iminio-3-sulfonato-2,5-cyclohexadien-1-ylidene)methyl]-3-methylbenzenesulfonate | C20H17N3O9S3

2-Amino-5-[(Z)-(4-amino-3-sulfonatophenyl)(4-iminio-3-sulfonato-2,5-cyclohexadien-1-ylidene)methyl]-3-methylbenzenesulfonate

  • Molecular FormulaC20H17N3O9S3
  • Average mass539.560 Da
  • Monoisotopic mass539.013794 Da
  • ChemSpider ID58163835

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

2-Amino-5-[(Z)-(4-amino-3-sulfonatophenyl)(4-iminio-3-sulfonato-2,5-cyclohexadien-1-yliden)methyl]-3-methylbenzolsulfonat [German] [ACD/IUPAC Name]
2-Amino-5-[(Z)-(4-amino-3-sulfonatophenyl)(4-iminio-3-sulfonato-2,5-cyclohexadien-1-ylidene)methyl]-3-methylbenzenesulfonate [ACD/IUPAC Name]
2-Amino-5-[(Z)-(4-amino-3-sulfonatophényl)(4-iminio-3-sulfonato-2,5-cyclohexadién-1-ylidène)méthyl]-3-méthylbenzènesulfonate [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 2-amino-5-[(Z)-(4-amino-3-sulfophenyl)(4-imino-3-sulfo-2,5-cyclohexadien-1-ylidene)methyl]-3-methyl-, inner salt, ion(2-) [ACD/Index Name]
2-amino-5-[(4-amino-3-sulfonatophenyl)(4-iminio-3-sulfonatocyclohexa-2,5-dien-1-ylidene)methyl]-3-methylbenzene-1-sulfonate
acid fuchsin anion
acid fuchsin dianion
acid fuchsin(2-)
  • Miscellaneous

    • Chemical Class:

      An organosulfonate oxoanion obtained by the removal of two protons from 2-amino-5-[(4-amino-3-sulfophenyl)(4-imino-3-sulfocyclohexa-2,5-dien-1-ylidene)methyl]-3-methylbenzene-1-sulfonic acid (the free acid form of the biological stain 'acid fuchsin'). ChEBI CHEBI:87062

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

Density:
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Enthalpy of Vaporization:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: -1.62
ACD/LogD (pH 5.5): -7.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.87
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 274 Å2
Polarizability:
Surface Tension:
Molar Volume:

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