ChemSpider 2D Image | 8-[Hydroxy(phenyl)2-pyridinylmethyl]-10-[phenyl(2-pyridinyl)methylene]-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione | C33H25N3O3

8-[Hydroxy(phenyl)2-pyridinylmethyl]-10-[phenyl(2-pyridinyl)methylene]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione

  • Molecular FormulaC33H25N3O3
  • Average mass511.570 Da
  • Monoisotopic mass511.189606 Da
  • ChemSpider ID13217

More details:

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

213-589-6 [EINECS]
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-5-(hydroxyphenyl-2-pyridinylmethyl)-8-(phenyl-2-pyridinylmethylene)- [ACD/Index Name]
8-[Hydroxy(phenyl)2-pyridinylmethyl]-10-[phenyl(2-pyridinyl)methylen]-4-azatricyclo[5.2.1.02,6]dec-8-en-3,5-dion [German] [ACD/IUPAC Name]
8-[Hydroxy(phenyl)2-pyridinylmethyl]-10-[phenyl(2-pyridinyl)methylene]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione [ACD/IUPAC Name]
8-[Hydroxy(phényl)2-pyridinylméthyl]-10-[phényl(2-pyridinyl)méthylène]-4-azatricyclo[5.2.1.02,6]déc-8-ène-3,5-dione [French] [ACD/IUPAC Name]
8-[Hydroxy(phenyl)pyridin-2-ylmethyl]-10-[phenyl(pyridin-2-yl)methylene]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
991-42-4 [RN]
3A,4,7,7A-TETRAHYDRO-5-(HYDROXYPHENYL-2-PYRIDINYLMETHYL)-8-(PHENYL -2-PYRIDINYLMETHYLENE)-4,7-METHANO-1H-ISOINDOLE-1,3(2H)-DIONE
4,7-Methano-1H-isoindole-1,3 (2H)-dione, 3a,4,7, 7a-tetrahydro-5-(hydroxyphenyl-2-pyridinylmethyl)-8-(phenyl-2-pyri dinylmethylene)-
4,7-Methano-1H-isoindole-1,3(2H)-dione, 3a,4,7,7a-tetrahydro-5-(hydroxyphenyl-2-pyridinylmethyl)-8-(phenyl-2-pyridinylmethylene)- (9CI)
More...

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

AI3-51762 [DBID]
Caswell No. 606 [DBID]
ENT 51,762 [DBID]
EPA Pesticide Chemical Code 086201 [DBID]
HSDB 1743 [DBID]
MCN 1025 [DBID]
NSC 101316 [DBID]
NSC101316 [DBID]
S 6999 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 780.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 425.9±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 145.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.77
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1338.37
ACD/KOC (pH 5.5): 5777.94
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1542.91
ACD/KOC (pH 7.4): 6660.96
Polar Surface Area: 92 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 380.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement