ChemSpider 2D Image | 3,3'-[(3,3'-Dimethyl-4,4'-biphenyldiyl)di(E)-2,1-diazenediyl]bis(4-amino-1-naphthalenesulfonic acid) | C34H28N6O6S2

3,3'-[(3,3'-Dimethyl-4,4'-biphenyldiyl)di(E)-2,1-diazenediyl]bis(4-amino-1-naphthalenesulfonic acid)

  • Molecular FormulaC34H28N6O6S2
  • Average mass680.753 Da
  • Monoisotopic mass680.151184 Da
  • ChemSpider ID13219
  • Double-bond stereo - Double-bond stereo

More details:

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

1-Naphthalenesulfonic acid, 3,3'-[(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)di(E)-2,1-diazenediyl]bis[4-amino- [ACD/Index Name]
3,3'-[(3,3'-Dimethyl-4,4'-biphenyldiyl)di(E)-2,1-diazendiyl]bis(4-amino-1-naphthalinsulfonsäure) [German] [ACD/IUPAC Name]
3,3'-[(3,3'-Dimethyl-4,4'-biphenyldiyl)di(E)-2,1-diazenediyl]bis(4-amino-1-naphthalenesulfonic acid) [ACD/IUPAC Name]
4-amino-3-[4-[4-[(1-amino-4-sulfo-2-naphthalenyl)azo]-3-methylphenyl]-2-methylphenyl]azo-1-naphthalenesulfonic acid
Acide 3,3'-[(3,3'-diméthyl-4,4'-biphényldiyl)di(E)-2,1-diazènediyl]bis(4-amino-1-naphtalènesulfonique) [French] [ACD/IUPAC Name]
Amanil purpurine 4B
Atul Direct Red 4B
Azocard Red 4B
Bencidal purple 4B
Benzanil purpurine 4B

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

AIDS073077 [DBID]
AIDS-073077 [DBID]
NSC5015 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.730
Molar Refractivity: 180.8±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 4
ACD/LogP: 5.14
ACD/LogD (pH 5.5): -0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 227 Å2
Polarizability: 71.7±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 453.2±7.0 cm3

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