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Search term: MF = 'C_{12}H_{12}N_{4}O_{4}'
ChemSpider 2D Image | Ethyl 5-amino-1-(4-nitrophenyl)-1H-pyrazole-3-carboxylate | C12H12N4O4

Ethyl 5-amino-1-(4-nitrophenyl)-1H-pyrazole-3-carboxylate

  • Molecular FormulaC12H12N4O4
  • Average mass276.248 Da
  • Monoisotopic mass276.085846 Da
  • ChemSpider ID24745998

More details:

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

1H-Pyrazole-3-carboxylic acid, 5-amino-1-(4-nitrophenyl)-, ethyl ester [ACD/Index Name]
5-Amino-1-(4-nitrophényl)-1H-pyrazole-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
866838-08-6 [RN]
Ethyl 5-amino-1-(4-nitrophenyl)-1H-pyrazole-3-carboxylate [ACD/IUPAC Name]
Ethyl-5-amino-1-(4-nitrophenyl)-1H-pyrazol-3-carboxylat [German] [ACD/IUPAC Name]
2-aminobenzo[d]thiazol-4-ol
2-Amino-benzothiazol-4-ol
5-amino-1-(4-nitrophenyl)-1h-pyrazole-3-carboxylic acid ethyl ester
atoms 20 bonds 21
ETHYL 5-AMINO-1-(4-NITROPHENYL)PYRAZOLE-3-CARBOXYLATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [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: 492.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.9±3.0 kJ/mol
    Flash Point: 251.5±25.9 °C
    Index of Refraction: 1.654
    Molar Refractivity: 69.4±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.05
    ACD/LogD (pH 5.5): 1.66
    ACD/BCF (pH 5.5): 10.80
    ACD/KOC (pH 5.5): 191.18
    ACD/LogD (pH 7.4): 1.66
    ACD/BCF (pH 7.4): 10.80
    ACD/KOC (pH 7.4): 191.18
    Polar Surface Area: 116 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 62.2±7.0 dyne/cm
    Molar Volume: 189.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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