Cas no 35371-03-0 (1-iodo-4-(methylsulfanyl)benzene)

1-Iodo-4-(methylsulfanyl)benzene is an organosulfur compound featuring both an iodine substituent and a methylthio group on a benzene ring. This structure makes it a versatile intermediate in organic synthesis, particularly in cross-coupling reactions such as Suzuki, Heck, and Sonogashira couplings, where the iodine moiety serves as an effective leaving group. The methylthio group enhances reactivity in further functionalization, enabling applications in pharmaceuticals, agrochemicals, and materials science. Its stability under standard conditions and well-defined reactivity profile contribute to its utility in precision synthesis. The compound is typically handled under inert conditions to preserve its integrity for high-yield transformations.
1-iodo-4-(methylsulfanyl)benzene structure
35371-03-0 structure
Product Name:1-iodo-4-(methylsulfanyl)benzene
CAS No:35371-03-0
MF:C7H7IS
MW:250.099952936172
MDL:MFCD00041454
CID:304187
PubChem ID:2759374
Update Time:2025-10-29

1-iodo-4-(methylsulfanyl)benzene Chemical and Physical Properties

Names and Identifiers

    • (4-Iodophenyl)(methyl)sulfane
    • 1-iodo-4-methylsulfanylbenzene
    • 4-Iodothioanisole
    • Benzene,1-iodo-4-(methylthio)-
    • p-Iodothioanisole
    • (4-iodophenyl)(methyl)thioether
    • 1-iodo-4-(methylsulfanyl)benzene
    • 4-iodo-1-methylthiobenzene
    • 4-iodophenyl methyl sulfide
    • 4-methylthioiodobenzene
    • VGQFOKHFPSTYJY-UHFFFAOYSA-N
    • 4-Iodothiaanisole
    • PubChem10670
    • 1-iodo-4-(methylthio)benzene
    • Benzene, 1-iodo-4-(methylthio)-
    • 1-iodanyl-4-methylsulfanyl-benzene
    • AS04301
    • I353
    • AB
    • AKOS009319465
    • AMY28216
    • J-515583
    • FS-4242
    • A822759
    • FT-0650745
    • CS-0150108
    • MFCD00041454
    • C7H7IS
    • EN300-206165
    • SCHEMBL514289
    • 35371-03-0
    • DTXSID20374770
    • MDL: MFCD00041454
    • Inchi: 1S/C7H7IS/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3
    • InChI Key: VGQFOKHFPSTYJY-UHFFFAOYSA-N
    • SMILES: IC1C=CC(=CC=1)SC

Computed Properties

  • Exact Mass: 249.93100
  • Monoisotopic Mass: 249.93132g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 1
  • Complexity: 77
  • 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: 3.8
  • Topological Polar Surface Area: 25.3

Experimental Properties

  • Color/Form: Not determined
  • Melting Point: 40 °C
  • Boiling Point: 262.6°C at 760 mmHg
  • PSA: 25.30000
  • LogP: 3.01310
  • Solubility: Not determined

1-iodo-4-(methylsulfanyl)benzene Security Information

1-iodo-4-(methylsulfanyl)benzene Customs Data

  • HS CODE:2930909090
  • Customs Data:

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

1-iodo-4-(methylsulfanyl)benzene Pricemore >>

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1-iodo-4-(methylsulfanyl)benzene Suppliers

Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:35371-03-0)4-IODOTHIOANISOLE
Order Number:sfd6622
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:34
Price ($):discuss personally
Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:35371-03-0)4-IODOTHIOANISOLE
sfd6622
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
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