Found 15 results

Search term: MF = 'C_{18}H_{12}Br_{2}Cl_{2}N_{2}O_{2}'
ChemSpider 2D Image | (4E)-4-(3,5-Dibromo-2-hydroxybenzylidene)-2-(3,4-dichlorobenzyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one | C18H12Br2Cl2N2O2

(4E)-4-(3,5-Dibromo-2-hydroxybenzylidene)-2-(3,4-dichlorobenzyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC18H12Br2Cl2N2O2
  • Average mass519.014 Da
  • Monoisotopic mass515.864258 Da
  • ChemSpider ID120012418

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-4-(3,5-Dibrom-2-hydroxybenzyliden)-2-(3,4-dichlorbenzyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
(4E)-4-(3,5-Dibromo-2-hydroxybenzylidene)-2-(3,4-dichlorobenzyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
(4E)-4-(3,5-Dibromo-2-hydroxybenzylidène)-2-(3,4-dichlorobenzyl)-5-méthyl-2,4-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
3H-Pyrazol-3-one, 4-[(3,5-dibromo-2-hydroxyphenyl)methylene]-2-[(3,4-dichlorophenyl)methyl]-2,4-dihydro-5-methyl-, (4E)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 570.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 298.7±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 110.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 6.55
ACD/LogD (pH 5.5): 6.33
ACD/BCF (pH 5.5): 36784.29
ACD/KOC (pH 5.5): 62141.56
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 3461.13
ACD/KOC (pH 7.4): 5847.06
Polar Surface Area: 53 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 54.6±7.0 dyne/cm
Molar Volume: 289.7±7.0 cm3

Click to predict properties on the Chemicalize site


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