Cas no 690632-26-9 (methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate)

methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate structure
690632-26-9 structure
Product Name:methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate
CAS No:690632-26-9
MF:C16H19BO4S
MW:318.195663690567
CID:841341
PubChem ID:2794650
Update Time:2025-04-19

methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[b]thiophene-2-carboxylate
    • METHYL 5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1-BENZOTHIOPHENE-2-CARBOXYLATE
    • METHYL 5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZOTHIOPHENE-2-CARBOXYLATE
    • MFCD05865112
    • methyl 5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate
    • AB22930
    • F83804
    • DTXSID10383295
    • Methyl5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzothiophene-2-carboxylate
    • CS-0369157
    • Z2050071856
    • SCHEMBL3451617
    • 690632-26-9
    • A836339
    • FT-0644848
    • EN300-12607816
    • AKOS016011926
    • Methyl5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[b]thiophene-2-carboxylate
    • Methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzothiophene-2-carboxylate
    • 2-Methyl 5-boronobenZo[b]thiophene-2-carboxylate pinacol ester
    • DB-008636
    • methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate
    • Inchi: 1S/C16H19BO4S/c1-15(2)16(3,4)21-17(20-15)11-6-7-12-10(8-11)9-13(22-12)14(18)19-5/h6-9H,1-5H3
    • InChI Key: XCYQFYKHKQJYJP-UHFFFAOYSA-N
    • SMILES: S1C(C(=O)OC)=CC2=C1C=CC(B1OC(C)(C)C(C)(C)O1)=C2

Computed Properties

  • Exact Mass: 318.11000
  • Monoisotopic Mass: 318.1097104g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 3
  • Complexity: 437
  • 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: 73?2

Experimental Properties

  • Melting Point: 110 °C
  • PSA: 73.00000
  • LogP: 2.98710

methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-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 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzothiophene-2-carboxylate Pricemore >>

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