ChemSpider 2D Image | (3Z,6E)-3,6-Bis[(4-chloro-2-phosphonophenyl)hydrazono]-4,5-dioxo-3,4,5,6-tetrahydro-2,7-naphthalenedisulfonic acid | C22H16Cl2N4O14P2S2

(3Z,6E)-3,6-Bis[(4-chloro-2-phosphonophenyl)hydrazono]-4,5-dioxo-3,4,5,6-tetrahydro-2,7-naphthalenedisulfonic acid

  • Molecular FormulaC22H16Cl2N4O14P2S2
  • Average mass757.364 Da
  • Monoisotopic mass755.895691 Da
  • ChemSpider ID8094180
  • Double-bond stereo - Double-bond stereo


More details:






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

(3Z,6E)-3,6-Bis[(4-chlor-2-phosphonophenyl)hydrazono]-4,5-dioxo-3,4,5,6-tetrahydro-2,7-naphthalindisulfonsäure [German] [ACD/IUPAC Name]
(3Z,6E)-3,6-Bis[(4-chloro-2-phosphonophenyl)hydrazono]-4,5-dioxo-3,4,5,6-tetrahydro-2,7-naphthalenedisulfonic acid [ACD/IUPAC Name]
2,7-Naphthalenedisulfonic acid, 3,6-bis[2-(4-chloro-2-phosphonophenyl)hydrazinylidene]-3,4,5,6-tetrahydro-4,5-dioxo-, (3Z,6E)- [ACD/Index Name]
Acide (3Z,6E)-3,6-bis[(4-chloro-2-phosphonophényl)hydrazono]-4,5-dioxo-3,4,5,6-tétrahydro-2,7-naphtalènedisulfonique [French] [ACD/IUPAC Name]
1914-99-4 [RN]
3,6-bis[(4-chloro-2-phosphonophenyl)hydrazinylidene]-4,5-dioxonaphthalene-2,7-disulfonic acid

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

Density: 2.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.811
Molar Refractivity: 156.9±0.5 cm3
#H bond acceptors: 18
#H bond donors: 8
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -0.37
ACD/LogD (pH 5.5): -8.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -10.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 343 Å2
Polarizability: 62.2±0.5 10-24cm3
Surface Tension: 113.1±7.0 dyne/cm
Molar Volume: 363.3±7.0 cm3

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