Found 20 results

Search term: MF = 'C_{20}H_{15}BrN_{6}O_{4}S'
ChemSpider 2D Image | 4-[(E)-(2-Bromo-4-nitrophenyl)diazenyl]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one | C20H15BrN6O4S

4-[(E)-(2-Bromo-4-nitrophenyl)diazenyl]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one

  • Molecular FormulaC20H15BrN6O4S
  • Average mass515.340 Da
  • Monoisotopic mass514.005859 Da
  • ChemSpider ID2356366

  • Double-bond stereo - Double-bond stereo

More details:

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

3H-Pyrazol-3-one, 4-[(E)-2-(2-bromo-4-nitrophenyl)diazenyl]-2,4-dihydro-2-[4-(4-methoxyphenyl)-2-thiazolyl]-5-methyl- [ACD/Index Name]
4-[(E)-(2-Brom-4-nitrophenyl)diazenyl]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-on [German] [ACD/IUPAC Name]
4-[(E)-(2-Bromo-4-nitrophenyl)diazenyl]-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-2,4-dihydro-3H-pyrazol-3-one [ACD/IUPAC Name]
4-[(E)-(2-Bromo-4-nitrophényl)diazényl]-2-[4-(4-méthoxyphényl)-1,3-thiazol-2-yl]-5-méthyl-2,4-dihydro-3H-pyrazol-3-one [French] [ACD/IUPAC Name]
3H-pyrazol-3-one, 4-[(2-bromo-4-nitrophenyl)azo]-2,4-dihydro-2-[4-(4-methoxyphenyl)-2-thiazolyl]-5-methyl-
4-[(2-bromo-4-nitrophenyl)diazenyl]-1-[4-(4-methoxyphenyl)(1,3-thiazol-2-yl)]-3-methyl-2-pyrazolin-5-one

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

BAS 00345205 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 666.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.0±3.0 kJ/mol
Flash Point: 357.0±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 123.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 3.99
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 867.05
ACD/KOC (pH 5.5): 4411.55
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 867.49
ACD/KOC (pH 7.4): 4413.76
Polar Surface Area: 154 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 66.5±7.0 dyne/cm
Molar Volume: 304.3±7.0 cm3

Click to predict properties on the Chemicalize site


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