Cas no 56723-86-5 (3-Methoxy-5-(trifluoromethyl)benzaldehyde)

3-Methoxy-5-(trifluoromethyl)benzaldehyde is a versatile aromatic aldehyde featuring both methoxy and trifluoromethyl functional groups. Its electron-withdrawing trifluoromethyl group enhances reactivity in electrophilic substitutions, while the methoxy group contributes to solubility and stability. This compound is particularly valuable in pharmaceutical and agrochemical synthesis, where its structural motifs are leveraged for bioactive molecule development. The trifluoromethyl group improves metabolic stability and lipophilicity, making it useful in drug design. High purity grades ensure consistent performance in coupling reactions, such as condensations or Grignard additions. Its well-defined chemical properties facilitate precise modifications in complex organic syntheses.
3-Methoxy-5-(trifluoromethyl)benzaldehyde structure
56723-86-5 structure
Product Name:3-Methoxy-5-(trifluoromethyl)benzaldehyde
CAS No:56723-86-5
MF:C9H7F3O2
MW:204.145893335342
MDL:MFCD08458144
CID:1029628
PubChem ID:21398997
Update Time:2025-05-27

3-Methoxy-5-(trifluoromethyl)benzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-Methoxy-5-(trifluoromethyl)benzaldehyde
    • 3-Methoxy-5-(trifluoromethyl)benzalderhyde
    • 3-Formyl-5-(trifluoromethyl)anisole
    • 3-Formyl-5-methoxybenzotrifluoride
    • 3-Methoxy-5-trifluoromethyl benzaldehyde
    • CL9142
    • PC9551
    • A869862
    • AC-28646
    • DTXSID00613093
    • CS-0130928
    • EN300-313378
    • 3-Formyl-5-methoxybenzotrifluoride, 3-Formyl-5-(trifluoromethyl)anisole
    • 3-Formyl-5-methoxybenzotrifluoride; CL9142;
    • SCHEMBL2600018
    • 56723-86-5
    • AKOS015956594
    • MFCD08458144
    • AB45627
    • AS-46222
    • Z1162210318
    • DTXCID60563848
    • MDL： MFCD08458144
    • Inchi： 1S/C9H7F3O2/c1-14-8-3-6(5-13)2-7(4-8)9(10,11)12/h2-5H,1H3
    • InChI Key： GAHAVZIKRCECQH-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(C=O)C=C(C=1)OC)(F)F

Computed Properties

  • Exact Mass: 204.04000
  • Monoisotopic Mass: 204.03981395g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 203
  • 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: 2.2
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.30000
  • LogP: 2.52650

3-Methoxy-5-(trifluoromethyl)benzaldehyde Security Information

  • Hazard Statement： Irritant
  • Hazardous Material Identification： Xi

3-Methoxy-5-(trifluoromethyl)benzaldehyde Customs Data

  • HS CODE：2913000090
  • Customs Data：

    China Customs Code:

    2913000090

    Overview:

    2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

3-Methoxy-5-(trifluoromethyl)benzaldehyde Pricemore >>

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3-Methoxy-5-(trifluoromethyl)benzaldehyde Production Method

3-Methoxy-5-(trifluoromethyl)benzaldehyde Related Literature

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