Found 21 results

Search term: MF = 'C_{29}H_{36}BrNO_{7}'
ChemSpider 2D Image | 5-(3-Bromo-4-butoxy-5-methoxyphenyl)-3-hydroxy-1-(2-isopropoxyethyl)-4-(4-methoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one | C29H36BrNO7

5-(3-Bromo-4-butoxy-5-methoxyphenyl)-3-hydroxy-1-(2-isopropoxyethyl)-4-(4-methoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC29H36BrNO7
  • Average mass590.503 Da
  • Monoisotopic mass589.167480 Da
  • ChemSpider ID117934744

More details:

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

2H-Pyrrol-2-one, 5-(3-bromo-4-butoxy-5-methoxyphenyl)-1,5-dihydro-3-hydroxy-4-(4-methoxy-3-methylbenzoyl)-1-[2-(1-methylethoxy)ethyl]- [ACD/Index Name]
5-(3-Brom-4-butoxy-5-methoxyphenyl)-3-hydroxy-1-(2-isopropoxyethyl)-4-(4-methoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-(3-Bromo-4-butoxy-5-methoxyphenyl)-3-hydroxy-1-(2-isopropoxyethyl)-4-(4-methoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-(3-Bromo-4-butoxy-5-méthoxyphényl)-3-hydroxy-1-(2-isopropoxyéthyl)-4-(4-méthoxy-3-méthylbenzoyl)-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: 1.3±0.1 g/cm3
Boiling Point: 690.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.3±3.0 kJ/mol
Flash Point: 371.6±31.5 °C
Index of Refraction: 1.573
Molar Refractivity: 148.8±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.34
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 338.14
ACD/KOC (pH 5.5): 1138.53
ACD/LogD (pH 7.4): 2.20
ACD/BCF (pH 7.4): 5.83
ACD/KOC (pH 7.4): 19.64
Polar Surface Area: 95 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 451.6±3.0 cm3

Click to predict properties on the Chemicalize site


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