Cas no 135242-71-6 (3-Hydroxy-4-iodobenzaldehyde)

3-Hydroxy-4-iodobenzaldehyde is a halogenated aromatic aldehyde with the molecular formula C?H?IO?. This compound features both an aldehyde and a hydroxyl group on a benzene ring, with an iodine substituent at the 4-position, making it a versatile intermediate in organic synthesis. Its distinct structure enables applications in cross-coupling reactions, such as Suzuki or Sonogashira couplings, due to the reactive iodine moiety. The hydroxyl group further allows for functionalization via etherification or esterification. This compound is particularly valuable in pharmaceutical and materials chemistry, where it serves as a precursor for bioactive molecules or advanced polymers. Its high purity and stability under standard conditions ensure reliable performance in synthetic workflows.
3-Hydroxy-4-iodobenzaldehyde structure
3-Hydroxy-4-iodobenzaldehyde structure
Product Name:3-Hydroxy-4-iodobenzaldehyde
CAS No:135242-71-6
MF:C7H5IO2
MW:248.017874479294
MDL:MFCD00114697
CID:138416
PubChem ID:2775270
Update Time:2025-06-24

3-Hydroxy-4-iodobenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 3-Hydroxy-4-iodobenzaldehyde
    • Benzaldehyde,3-hydroxy-4-iodo-
    • A806909
    • 3-hydroxy-4-iodobenzaldehyde, AldrichCPR
    • SCHEMBL430962
    • W-205459
    • DTXSID20379487
    • PS-4204
    • AMY10229
    • Benzaldehyde, 3-hydroxy-4-iodo-
    • 135242-71-6
    • AKOS005145571
    • CS-0038831
    • MFCD00114697
    • 3-hydroxy-4-iodo-benzaldehyde
    • AC-4647
    • SY045980
    • FT-0643233
    • 5-Formyl-2-iodophenol
    • IHLOHISMHMTTAA-UHFFFAOYSA-N
    • DB-005301
    • MDL: MFCD00114697
    • Inchi: 1S/C7H5IO2/c8-6-2-1-5(4-9)3-7(6)10/h1-4,10H
    • InChI Key: IHLOHISMHMTTAA-UHFFFAOYSA-N
    • SMILES: IC1C=CC(C=O)=CC=1O

Computed Properties

  • Exact Mass: 247.93300
  • Monoisotopic Mass: 247.933
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 127
  • 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
  • Topological Polar Surface Area: 37.3A^2
  • XLogP3: 1.7

Experimental Properties

  • Color/Form: Pale-yellow to Yellow-brown Solid
  • Density: 2.039
  • Melting Point: 131-132 °C
  • Boiling Point: 252.3°Cat760mmHg
  • Flash Point: 106.4°C
  • Refractive Index: 1.715
  • PSA: 37.30000
  • LogP: 1.80930

3-Hydroxy-4-iodobenzaldehyde Security Information

  • Signal Word:Danger
  • Hazard Statement: H302;H317;H318
  • Warning Statement: P280;P305+P351+P338
  • Hazard Category Code: R36/37/38
  • Safety Instruction: S26
  • Hazardous Material Identification: Xi
  • Safety Term:S26-36/37/39-66-22
  • Risk Phrases:R36/37/38
  • Storage Condition:2-8 °C

3-Hydroxy-4-iodobenzaldehyde 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-Hydroxy-4-iodobenzaldehyde Pricemore >>

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3-Hydroxy-4-iodobenzaldehyde Related Literature

  • 1. Total syntheses of riccardins A, B, and C, cytotoxic macrocyclic bis(bibenzyls) from liverworts
    ágnes Gottsegen,Mihály Nógrádi,Borbála Vermes,Mária Kajtár-Peredy,éva Bihátsi-Karsai J. Chem. Soc. Perkin Trans. 1 1990 315
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