Cas no 648412-60-6 (Methyl 4-bromo-5-cyanothiophene-2-carboxylate)

Methyl 4-bromo-5-cyanothiophene-2-carboxylate structure
648412-60-6 structure
Product Name:Methyl 4-bromo-5-cyanothiophene-2-carboxylate
CAS No:648412-60-6
MF:C7H4BrNO2S
MW:246.081159591675
CID:415393
PubChem ID:68825822
Update Time:2025-04-19

Methyl 4-bromo-5-cyanothiophene-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-bromo-5-cyanothiophene-2-carboxylate
    • 2-Thiophenecarboxylic acid, 4-bromo-5-cyano-, methyl ester
    • 648412-60-6
    • F83560
    • CLUNERGOTORYPP-UHFFFAOYSA-N
    • SCHEMBL3882941
    • CS-0301888
    • EN300-5235826
    • AMY10029
    • FT-0759951
    • Methyl4-bromo-5-cyanothiophene-2-carboxylate
    • DTXSID90739115
    • Z1551958723
    • DA-32493
    • MDL： MFCD22200340
    • Inchi： 1S/C7H4BrNO2S/c1-11-7(10)5-2-4(8)6(3-9)12-5/h2H,1H3
    • InChI Key： CLUNERGOTORYPP-UHFFFAOYSA-N
    • SMILES： BrC1=C(C#N)SC(C(=O)OC)=C1

Computed Properties

  • Exact Mass: 244.91500
  • Monoisotopic Mass: 244.91461g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 2
  • Complexity: 237
  • 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: 78.3?2

Experimental Properties

  • PSA: 78.33000
  • LogP: 2.16888

Methyl 4-bromo-5-cyanothiophene-2-carboxylate Customs Data

  • HS CODE：2934999090
  • Customs Data：

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic 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

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Methyl 4-bromo-5-cyanothiophene-2-carboxylate Pricemore >>

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