ChemSpider 2D Image | 4-Amino-3-[(E)-{4'-[(E)-(2-amino-6-sulfo-1-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-1-naphthalenesulfonic acid | C34H28N6O6S2

4-Amino-3-[(E)-{4'-[(E)-(2-amino-6-sulfo-1-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-1-naphthalenesulfonic acid

  • Molecular FormulaC34H28N6O6S2
  • Average mass680.753 Da
  • Monoisotopic mass680.151184 Da
  • ChemSpider ID4957500

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Naphthalenesulfonic acid, 4-amino-3-[(E)-2-[4'-[(E)-2-(2-amino-6-sulfo-1-naphthalenyl)diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]- [ACD/Index Name]
4-Amino-3-[(E)-{4'-[(E)-(2-amino-6-sulfo-1-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-1-naphthalenesulfonic acid [ACD/IUPAC Name]
4-Amino-3-[(E)-{4'-[(E)-(2-amino-6-sulfo-1-naphthyl)diazenyl]-3,3'-dimethyl-4-biphenylyl}diazenyl]-1-naphthalinsulfonsäure [German] [ACD/IUPAC Name]
Acide 4-amino-3-[(E)-{4'-[(E)-(2-amino-6-sulfo-1-naphtyl)diazényl]-3,3'-diméthyl-4-biphénylyl}diazényl]-1-naphtalènesulfonique [French] [ACD/IUPAC Name]

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

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: 3
ACD/LogP: 4.44
ACD/LogD (pH 5.5): -1.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.43
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

Click to predict properties on the Chemicalize site


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