ChemSpider 2D Image | 253H13NWCQ | C42H57N3O6

253H13NWCQ

  • Molecular FormulaC42H57N3O6
  • Average mass699.919 Da
  • Monoisotopic mass699.424744 Da
  • ChemSpider ID84161

More details:

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

1,3,5-TRI(4-TERT-BUTYL-2,6-DIMETHYL-3-HYDROXYBENZYL)-1,3,5-TRIAZINE-2,4,6(1H,3H,5H)-TRIONE
1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1,3,5-tris[[4-(1,1-dimethylethyl)-3-hydroxy-2,6-dimethylphenyl]methyl]- [ACD/Index Name]
1,3,5-Tris(4-tert-butyl-3-hydroxy-2,6-dimethylbenzyl)-1,3,5-triazinane-2,4,6-trione
1,3,5-Tris[3-hydroxy-2,6-dimethyl-4-(2-methyl-2-propanyl)benzyl]-1,3,5-triazinan-2,4,6-trion [German] [ACD/IUPAC Name]
1,3,5-Tris[3-hydroxy-2,6-dimethyl-4-(2-methyl-2-propanyl)benzyl]-1,3,5-triazinane-2,4,6-trione [ACD/IUPAC Name]
1,3,5-Tris[3-hydroxy-2,6-diméthyl-4-(2-méthyl-2-propanyl)benzyl]-1,3,5-triazinane-2,4,6-trione [French] [ACD/IUPAC Name]
253H13NWCQ
254-996-9 [EINECS]
40601-76-1 [RN]
Cyanox 1790
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

413224_ALDRICH [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 793.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.5±3.0 kJ/mol
Flash Point: 433.9±32.9 °C
Index of Refraction: 1.593
Molar Refractivity: 202.2±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.03
ACD/LogD (pH 5.5): 7.88
ACD/BCF (pH 5.5): 578011.13
ACD/KOC (pH 5.5): 463409.16
ACD/LogD (pH 7.4): 7.88
ACD/BCF (pH 7.4): 577948.94
ACD/KOC (pH 7.4): 463359.28
Polar Surface Area: 122 Å2
Polarizability: 80.2±0.5 10-24cm3
Surface Tension: 51.1±3.0 dyne/cm
Molar Volume: 597.0±3.0 cm3

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