Cas no 175137-35-6 (ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate)

ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate structure
175137-35-6 structure
Product Name:ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate
CAS No:175137-35-6
MF:C13H10F3N3O4
MW:329.23141336441
MDL:MFCD00173868
CID:92112
PubChem ID:24884419
Update Time:2025-04-18

ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
    • Ethyl 2-(4-nitrophenyl)-3-(trifluoromethyl)-pyrazole-4-carboxylate
    • ETHYL 2-(4-NITROPHENYL)-3-(TRIFLUOROMETHYL)PYRAZOLE-4-CARBOXYLATE
    • ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate
    • BUTTPARK 146\18-06
    • ETHYL 1-(4-NITROPHENYL)-5-(TRIFLUOROMET&
    • Ethyl 2-(4-nitrophenyl)-3-(trifluoromethyl)-
    • Ethyl 2-(4-Nitrophenyl)-3-(Trifluoromethyl)Pyrazole-4-Carbo
    • Ethyl2-(4-nitrophenyl)-3-(trifluoromethyl)-pyrazole-4-carboxyla
    • ETHYL 2-(4-NITROPHENYL)-3-(TRIFLUOROMETHYL) -N PYRAZOLE-4-CARBOXYLATE
    • Ethyl2-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole-4-carboxylate97%
    • Ethyl 2-(4-nitrophenyl)-3-(trifluoromethyl)pyrazole-4-carboxylate 97%
    • Maybridge1_003926
    • DTXSID50371919
    • 1H-Pyrazole-4-carboxylic acid, 1-(4-nitrophenyl)-5-(trifluoromethyl)-, ethyl ester
    • AS-73934
    • A811790
    • SCHEMBL6070165
    • Ethyl 5-(trifluoromethyl)-1-(4-nitrophenyl)-1H-pyrazole-4-carboxylate
    • Ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate, 97%
    • MFCD00173868
    • J-011070
    • C13H10F3N3O4
    • SB74720
    • AKOS015833409
    • HMS552K10
    • 1-(4-nitrophenyl)-5-trifluoromethyl-1H-pyrazole-4-carboxylic acid ethyl ester
    • D94560
    • 175137-35-6
    • FT-0625870
    • 1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxylic acid ethyl ester
    • CS-0151854
    • DB-044053
    • MDL: MFCD00173868
    • Inchi: 1S/C13H10F3N3O4/c1-2-23-12(20)10-7-17-18(11(10)13(14,15)16)8-3-5-9(6-4-8)19(21)22/h3-7H,2H2,1H3
    • InChI Key: QNUASRIZVSLLGS-UHFFFAOYSA-N
    • SMILES: FC(C1=C(C(=O)OCC)C=NN1C1C=CC(=CC=1)[N+](=O)[O-])(F)F

Computed Properties

  • Exact Mass: 329.06200
  • Monoisotopic Mass: 329.062
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 6
  • Complexity: 447
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.9
  • Topological Polar Surface Area: 89.9A^2

Experimental Properties

  • Color/Form: Yellow crystalline powder
  • Density: 1.64
  • Melting Point: 106-110?°C
  • Boiling Point: 421.8°C at 760 mmHg
  • Flash Point: 208.9°C
  • Refractive Index: 1.599
  • PSA: 89.94000
  • LogP: 3.49920
  • Solubility: Insoluble in water
  • Vapor Pressure: 0.0±1.0 mmHg at 25°C

ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H302-H319
  • Warning Statement: P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 22-36
  • Safety Instruction: S26
  • Hazardous Material Identification: Xn Xi
  • Risk Phrases:R22; R36
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)

ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Customs Data

  • HS CODE:2933199090
  • Customs Data:

    China Customs Code:

    2933199090

    Overview:

    2933199090. Other structurally non fused pyrazole ring compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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ethyl 1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Production Method

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