Found 7 results

Search term: MF = 'C_{33}H_{31}Cl_{2}NO_{6}'
ChemSpider 2D Image | 4-(2,4-Dichlorobenzoyl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)-3-hydroxy-5-{4-[(4-methylbenzyl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one | C33H31Cl2NO6

4-(2,4-Dichlorobenzoyl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)-3-hydroxy-5-{4-[(4-methylbenzyl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC33H31Cl2NO6
  • Average mass608.508 Da
  • Monoisotopic mass607.152832 Da
  • ChemSpider ID118237384

More details:

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

2H-Pyrrol-2-one, 4-(2,4-dichlorobenzoyl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)-1,5-dihydro-3-hydroxy-5-[4-[(4-methylphenyl)methoxy]phenyl]- [ACD/Index Name]
4-(2,4-Dichlorbenzoyl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)-3-hydroxy-5-{4-[(4-methylbenzyl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
4-(2,4-Dichlorobenzoyl)-1-(1,4-dioxaspiro[4.5]dec-8-yl)-3-hydroxy-5-{4-[(4-methylbenzyl)oxy]phenyl}-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
4-(2,4-Dichlorobenzoyl)-1-(1,4-dioxaspiro[4.5]déc-8-yl)-3-hydroxy-5-{4-[(4-méthylbenzyl)oxy]phényl}-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 788.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.3±3.0 kJ/mol
Flash Point: 430.7±32.9 °C
Index of Refraction: 1.670
Molar Refractivity: 159.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.39
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 1439.36
ACD/KOC (pH 5.5): 3210.94
ACD/LogD (pH 7.4): 3.02
ACD/BCF (pH 7.4): 24.83
ACD/KOC (pH 7.4): 55.39
Polar Surface Area: 85 Å2
Polarizability: 63.2±0.5 10-24cm3
Surface Tension: 67.0±5.0 dyne/cm
Molar Volume: 427.0±5.0 cm3

Click to predict properties on the Chemicalize site


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