Cas no 874299-07-7 (3-(3-Butylureido)phenylboronic acid, pinacol ester)

3-(3-Butylureido)phenylboronic acid, pinacol ester structure
874299-07-7 structure
Product Name:3-(3-Butylureido)phenylboronic acid, pinacol ester
CAS No:874299-07-7
MF:C17H27BN2O3
MW:318.218884706497
MDL:MFCD06659931
CID:856572
PubChem ID:46738656
Update Time:2025-04-19

3-(3-Butylureido)phenylboronic acid, pinacol ester Chemical and Physical Properties

Names and Identifiers

    • 1-Butyl-3-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)urea
    • 1-butyl-3-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
    • 3-(3-Butylureido)phenylboronic acid, pinacol ester
    • OR360861
    • AX8230407
    • ST24021282
    • N-Butyl-N'-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
    • 3-BUTYL-1-[3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL]UREA
    • ZJB29907
    • CS-0175918
    • MFCD06659931
    • D93213
    • AS-72480
    • DTXSID50674316
    • 3-(3-Butylureido)phenylboronic acid pinacol ester
    • 874299-07-7
    • A862598
    • 3-(3-Butylureido)phenylboronic acid,pinacol ester
    • AKOS015999436
    • MDL: MFCD06659931
    • Inchi: 1S/C17H27BN2O3/c1-6-7-11-19-15(21)20-14-10-8-9-13(12-14)18-22-16(2,3)17(4,5)23-18/h8-10,12H,6-7,11H2,1-5H3,(H2,19,20,21)
    • InChI Key: DYBDTMCEAHKZHI-UHFFFAOYSA-N
    • SMILES: O1B(C2C=CC=C(C=2)NC(NCCCC)=O)OC(C)(C)C1(C)C

Computed Properties

  • Exact Mass: 318.21100
  • Monoisotopic Mass: 318.2114729g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 5
  • Complexity: 399
  • 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: 59.6

Experimental Properties

  • PSA: 59.59000
  • LogP: 3.37130

3-(3-Butylureido)phenylboronic acid, pinacol ester Security Information

  • Storage Condition:Sealed in dry,2-8°C(BD230407)

3-(3-Butylureido)phenylboronic 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-(3-Butylureido)phenylboronic acid, pinacol ester Pricemore >>

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