ChemSpider 2D Image | 1-[(E)-({2-Methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]-2-naphthol | C24H17N5O7

1-[(E)-({2-Methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]-2-naphthol

  • Molecular FormulaC24H17N5O7
  • Average mass487.421 Da
  • Monoisotopic mass487.112793 Da
  • ChemSpider ID22825275

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(E)-({2-Methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]-2-naphthol [ACD/IUPAC Name]
1-[(E)-({2-Methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]-2-naphthol [German] [ACD/IUPAC Name]
1-[(E)-({2-Méthyl-5-[(2,4,6-trinitrophényl)amino]phényl}imino)méthyl]-2-naphtol [French] [ACD/IUPAC Name]
2-Naphthalenol, 1-[(E)-[[2-methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl]imino]methyl]- [ACD/Index Name]
1-[({2-methyl-5-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]-2-naphthol

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

Density: 1.5±0.1 g/cm3
Boiling Point: 673.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 361.0±31.5 °C
Index of Refraction: 1.704
Molar Refractivity: 126.7±0.5 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.31
ACD/LogD (pH 5.5): 6.26
ACD/BCF (pH 5.5): 33597.80
ACD/KOC (pH 5.5): 60304.11
ACD/LogD (pH 7.4): 6.22
ACD/BCF (pH 7.4): 30332.01
ACD/KOC (pH 7.4): 54442.38
Polar Surface Area: 182 Å2
Polarizability: 50.2±0.5 10-24cm3
Surface Tension: 67.7±7.0 dyne/cm
Molar Volume: 326.3±7.0 cm3

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