ChemSpider 2D Image | 5-Amino-3-[(E)-{4'-[(Z)-(8-amino-1-hydroxy-3,6-disulfo-2-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid | C34H28N6O14S4

5-Amino-3-[(E)-{4'-[(Z)-(8-amino-1-hydroxy-3,6-disulfo-2-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid

  • Molecular FormulaC34H28N6O14S4
  • Average mass872.878 Da
  • Monoisotopic mass872.054626 Da
  • ChemSpider ID23009986

  • Double-bond stereo - Double-bond stereo

More details:

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

2,7-Naphthalenedisulfonic acid, 5-amino-3-[(E)-2-[4'-[(Z)-2-(8-amino-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-4-hydroxy- [ACD/Index Name]
5-Amino-3-[(E)-{4'-[(Z)-(8-amino-1-hydroxy-3,6-disulfo-2-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-4-hydroxy-2,7-naphthalenedisulfonic acid [ACD/IUPAC Name]
5-Amino-3-[(E)-{4'-[(Z)-(8-amino-1-hydroxy-3,6-disulfo-2-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-4-hydroxy-2,7-naphthalindisulfonsäure [German] [ACD/IUPAC Name]
Acide 5-amino-3-[(E)-{4'-[(Z)-(8-amino-1-hydroxy-3,6-disulfo-2-naphtyl)diazényl]-3,3'-diméthyl-4-biphénylyl}diazényl]-4-hydroxy-2,7-naphtalènedisulfonique [French] [ACD/IUPAC Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.788
Molar Refractivity: 203.8±0.5 cm3
#H bond acceptors: 20
#H bond donors: 10
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -4.00
ACD/LogD (pH 5.5): -9.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 393 Å2
Polarizability: 80.8±0.5 10-24cm3
Surface Tension: 87.6±7.0 dyne/cm
Molar Volume: 482.1±7.0 cm3

Click to predict properties on the Chemicalize site


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