ChemSpider 2D Image | 2,2'-Ethene-1,2-diylbis[5-({4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonic acid] | C40H44N12O10S2

2,2'-Ethene-1,2-diylbis[5-({4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonic acid]

  • Molecular FormulaC40H44N12O10S2
  • Average mass916.982 Da
  • Monoisotopic mass916.274475 Da
  • ChemSpider ID39216

More details:

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

2,2'-[(E)-1,2-Ethendiyl]bis[5-({4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzolsulfonsäure] [German] [ACD/IUPAC Name]
2,2'-[(E)-1,2-Ethenediyl]bis[5-({4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonic acid] [ACD/IUPAC Name]
2,2'-Ethene-1,2-diylbis[5-({4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino)benzenesulfonic acid]
224-548-7 [EINECS]
4404-43-7 [RN]
Acide 2,2'-[(E)-1,2-éthènediyl]bis[5-({4-anilino-6-[bis(2-hydroxyéthyl)amino]-1,3,5-triazin-2-yl}amino)benzènesulfonique] [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 2,2'-[(E)-1,2-ethenediyl]bis[5-[[4-[bis(2-hydroxyethyl)amino]-6-(phenylamino)-1,3,5-triazin-2-yl]amino]- [ACD/Index Name]
T6N CN ENJ BN2Q2Q DMR& FMR CSWQ D1U1R BSWQ DM- BT6N CN ENJ DN2Q2Q FMR [WLN]
4,4'-bis((4-(bis(2-hydroxyethyl)amino)-6-anilino-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulphonic acid
4,4'-bis((4-anilino-6-(bis(2-hydroxyethyl)amino)-1,3,5-triazin-2-yl)amino)stilbene-2,2'-disulfonic acid
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  • Miscellaneous

    • Chemical Class:

      An organosulfonic acid comprising stilbene having 4-anilino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl}amino groups at the 4 and 4'-positions and sulfo groups at the 2- and 2'-positions. ChEBI CHEBI:50010

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.745
Molar Refractivity: 232.5±0.4 cm3
#H bond acceptors: 22
#H bond donors: 10
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 3
ACD/LogP: -2.28
ACD/LogD (pH 5.5): -5.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 338 Å2
Polarizability: 92.2±0.5 10-24cm3
Surface Tension: 107.5±3.0 dyne/cm
Molar Volume: 573.7±3.0 cm3

Click to predict properties on the Chemicalize site


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