Cas no 1218791-30-0 (3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester)

3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester structure
1218791-30-0 structure
Product Name:3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester
CAS No:1218791-30-0
MF:C17H25BO4
MW:304.189005613327
MDL:MFCD12546475
CID:828313
PubChem ID:46739510
Update Time:2025-08-05

3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester Chemical and Physical Properties

Names and Identifiers

    • Isopropyl 3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
    • 3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester
    • propan-2-yl 3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
    • 3-(Isopropoxycarbonyl)-5-methylphenylboronic acid pinacol ester
    • 3-(Isopropoxycarbonyl)-5-methylphenylboronic acid,pinacol ester
    • CS-0174249
    • MFCD12546475
    • Isopropyl3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
    • BS-21230
    • AKOS016004737
    • 1218791-30-0
    • DTXSID60675112
    • DB-365651
    • Benzoic acid, 3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1-methylethyl ester
    • MDL: MFCD12546475
    • Inchi: 1S/C17H25BO4/c1-11(2)20-15(19)13-8-12(3)9-14(10-13)18-21-16(4,5)17(6,7)22-18/h8-11H,1-7H3
    • InChI Key: IJZINCHSUOKFFX-UHFFFAOYSA-N
    • SMILES: O1B(C2C=C(C(=O)OC(C)C)C=C(C)C=2)OC(C)(C)C1(C)C

Computed Properties

  • Exact Mass: 304.18500
  • Monoisotopic Mass: 304.185
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 4
  • Complexity: 403
  • 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: 44.8A^2

Experimental Properties

  • PSA: 44.76000
  • LogP: 2.85940

3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester 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%

3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester Pricemore >>

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abcr
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3-(Isopropoxycarbonyl)-5-methylphenylboronic acid, pinacol ester, 98%; .
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