ChemSpider 2D Image | (4E,4'E)-2,2'-[(4-Hydroxyphenyl)methylene]bis(4-{[(5-methyl-1H-tetrazol-1-yl)amino]methylene}-2,5-cyclohexadien-1-one) | C25H22N10O3

(4E,4'E)-2,2'-[(4-Hydroxyphenyl)methylene]bis(4-{[(5-methyl-1H-tetrazol-1-yl)amino]methylene}-2,5-cyclohexadien-1-one)

  • Molecular FormulaC25H22N10O3
  • Average mass510.507 Da
  • Monoisotopic mass510.187622 Da
  • ChemSpider ID4981737

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E,4'E)-2,2'-[(4-Hydroxyphenyl)methylen]bis(4-{[(5-methyl-1H-tetrazol-1-yl)amino]methylen}-2,5-cyclohexadien-1-on) [German] [ACD/IUPAC Name]
(4E,4'E)-2,2'-[(4-Hydroxyphenyl)methylene]bis(4-{[(5-methyl-1H-tetrazol-1-yl)amino]methylene}-2,5-cyclohexadien-1-one) [ACD/IUPAC Name]
(4E,4'E)-2,2'-[(4-Hydroxyphényl)méthylène]bis(4-{[(5-méthyl-1H-tétrazol-1-yl)amino]méthylène}-2,5-cyclohexadién-1-one) [French] [ACD/IUPAC Name]
2,5-Cyclohexadien-1-one, 2,2'-[(4-hydroxyphenyl)methylene]bis[4-[[(5-methyl-1H-tetrazol-1-yl)amino]methylene]-, (4E,4'E)- [ACD/Index Name]
235106-62-4 [RN]
Phenol, 2,2'-[(4-hydroxyphenyl)methylene]bis[4-[(E)-[(5-methyl-1H-tetrazol-1-yl)imino]methyl]- [ACD/Index Name]
VP 14637

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

AIDS336025 [DBID]
AIDS-336025 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 788.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 118.7±3.0 kJ/mol
Flash Point: 430.6±35.7 °C
Index of Refraction: 1.754
Molar Refractivity: 139.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.82
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.52
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.42
Polar Surface Area: 166 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 66.4±7.0 dyne/cm
Molar Volume: 341.2±7.0 cm3

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