ChemSpider 2D Image | [3-(4-Methoxyphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophenyl]methanone | C27H24N6O9

[3-(4-Methoxyphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophenyl]methanone

  • Molecular FormulaC27H24N6O9
  • Average mass576.514 Da
  • Monoisotopic mass576.160461 Da
  • ChemSpider ID2376872

More details:

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

[3-(4-Methoxyphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophenyl]methanon [German] [ACD/IUPAC Name]
[3-(4-Methoxyphenyl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophenyl]methanone [ACD/IUPAC Name]
[3-(4-Méthoxyphényl)-5-(3-nitrophényl)-4,5-dihydro-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophényl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4,5-dihydro-3-(4-methoxyphenyl)-5-(3-nitrophenyl)-1H-pyrazol-1-yl][4-(4-morpholinyl)-3,5-dinitrophenyl]- [ACD/Index Name]
[5-(4-methoxyphenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazol-2-yl]-(4-morpholin-4-yl-3,5-dinitrophenyl)methanone
328556-56-5 [RN]
4-(2,6-bisnitro-4-{[5-{3-nitrophenyl}-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]carbonyl}phenyl)morpholine
AC1MK2S1
AGN-PC-0KPJJ0
AKOS000646401
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AG-690/12557838 [DBID]
BAS 00943162 [DBID]
ChemDiv1_001808 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 770.8±70.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 112.2±3.0 kJ/mol
    Flash Point: 420.0±35.7 °C
    Index of Refraction: 1.703
    Molar Refractivity: 145.6±0.5 cm3
    #H bond acceptors: 15
    #H bond donors: 0
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 4.36
    ACD/LogD (pH 5.5): 4.20
    ACD/BCF (pH 5.5): 912.64
    ACD/KOC (pH 5.5): 4577.02
    ACD/LogD (pH 7.4): 4.20
    ACD/BCF (pH 7.4): 912.64
    ACD/KOC (pH 7.4): 4577.02
    Polar Surface Area: 192 Å2
    Polarizability: 57.7±0.5 10-24cm3
    Surface Tension: 69.4±7.0 dyne/cm
    Molar Volume: 375.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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