ChemSpider 2D Image | 5-[(2E)-2-{2-Anilino-1-[(E)-(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxoethylidene}hydrazino]-4-methoxy-2-nitrobenzenesulfonic acid | C22H19N7O13S2

5-[(2E)-2-{2-Anilino-1-[(E)-(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxoethylidene}hydrazino]-4-methoxy-2-nitrobenzenesulfonic acid

  • Molecular FormulaC22H19N7O13S2
  • Average mass653.555 Da
  • Monoisotopic mass653.048218 Da
  • ChemSpider ID4585459

  • Double-bond stereo - Double-bond stereo

More details:

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

5-[(2E)-2-{2-Anilino-1-[(E)-(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxoethyliden}hydrazino]-4-methoxy-2-nitrobenzolsulfonsäure [German] [ACD/IUPAC Name]
5-[(2E)-2-{2-Anilino-1-[(E)-(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxoethylidene}hydrazino]-4-methoxy-2-nitrobenzenesulfonic acid [ACD/IUPAC Name]
Acide 5-[(2E)-2-{2-anilino-1-[(E)-(2-méthoxy-4-nitro-5-sulfophényl)diazényl]-2-oxoéthylidène}hydrazino]-4-méthoxy-2-nitrobenzènesulfonique [French] [ACD/IUPAC Name]
Benzenesulfonic acid, 4-methoxy-5-[(2E)-2-[1-[(E)-2-(2-methoxy-4-nitro-5-sulfophenyl)diazenyl]-2-oxo-2-(phenylamino)ethylidene]hydrazinyl]-2-nitro- [ACD/Index Name]
1,5-bis(2-methoxy-4-nitro-5-sulfophenyl)-3-((phenylamino)carbonyl)formazan
70709-62-5 [RN]
Benzenesulfonic acid, 3,3'-(3-((phenylamino)carbonyl)-1,5-formazandiyl)bis(4-methoxy-6-nitro-
Xtt formazan

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.707
Molar Refractivity: 147.4±0.5 cm3
#H bond acceptors: 20
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 5.91
ACD/LogD (pH 5.5): -2.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 314 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 80.2±7.0 dyne/cm
Molar Volume: 378.2±7.0 cm3

Click to predict properties on the Chemicalize site


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