Cas no 890626-54-7 (1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde)

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde structure
890626-54-7 structure
Product Name:1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
CAS No:890626-54-7
MF:C12H11FN2O
MW:218.226946115494
MDL:MFCD06655672
CID:714444
PubChem ID:4962243
Update Time:2025-09-22

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
    • 1-(4-Fluoro-phenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
    • 1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carbaldehyde
    • 1H-Pyrazole-4-carboxaldehyde,1-(4-fluorophenyl)-3,5-dimethyl-
    • BB_SC-3641
    • 1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxaldehyde (ACI)
    • 890626-54-7
    • BBL012411
    • Z89271891
    • MFCD06655672
    • AKOS000206714
    • STK501294
    • DB-028467
    • VS-03334
    • G29646
    • CS-0233146
    • SR-01000068488
    • F3250-0732
    • 1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde, AldrichCPR
    • 1H-pyrazole-4-carboxaldehyde, 1-(4-fluorophenyl)-3,5-dimethyl-
    • EN300-13116
    • SR-01000068488-1
    • ALBB-009319
    • DTXSID50407040
    • MDL： MFCD06655672
    • Inchi： 1S/C12H11FN2O/c1-8-12(7-16)9(2)15(14-8)11-5-3-10(13)4-6-11/h3-7H,1-2H3
    • InChI Key： AXOXHQSHPSKAID-UHFFFAOYSA-N
    • SMILES： O=CC1=C(C)N(C2C=CC(F)=CC=2)N=C1C

Computed Properties

  • Exact Mass: 218.08600
  • Monoisotopic Mass: 218.08554114g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 253
  • 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
  • XLogP3: 2.5
  • Topological Polar Surface Area: 34.9?2

Experimental Properties

  • Density: 1.19
  • Boiling Point: 335°C at 760 mmHg
  • Flash Point: 156.4°C
  • Refractive Index: 1.571
  • PSA: 34.89000
  • LogP: 2.44070

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Security Information

  • Symbol: GHS07
  • Signal Word：Warning
  • Hazard Statement： H302
  • Hazardous Material transportation number：NONH for all modes of transport
  • Hazard Category Code： 22
  • Hazardous Material Identification： Xn
  • HazardClass：IRRITANT

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde 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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1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Phosphorus oxychloride Solvents: Dimethylformamide ;  -5 °C; 1 h, -5 °C; -5 °C → 80 °C
1.2 80 °C; 5 h, 80 °C
1.3 Reagents: Water ;  overnight, cooled
1.4 Reagents: Sodium bicarbonate Solvents: Water ;  pH 5 - 6
Reference
Synthesis and characterization of novel arylformoylpyrazole
Liu, Shu-yun; Ren, Tie-gang; Chen, Hong-bin; Li, Gui-hui, Henan Daxue Xuebao, 2012, 42(2), 154-158

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Raw materials

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Preparation Products

1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:890626-54-7)1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
Order Number:A1093337
Stock Status:in Stock
Quantity:5g/10g/25g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 20:09
Price ($):188.0/284.0/636.0

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890626-54-7 (1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde) Related Products

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Amadis Chemical Company Limited
(CAS:890626-54-7)1-(4-Fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carbaldehyde
A1093337
Purity:99%/99%/99%
Quantity:5g/10g/25g
Price ($):188.0/284.0/636.0
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