Cas no 943552-01-0 (6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione)

6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione structure
943552-01-0 structure
Product Name:6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione
CAS No:943552-01-0
MF:C12H14BNO4
MW:247.054863452911
MDL:MFCD11215237
CID:2083383
PubChem ID:329761993
Update Time:2025-04-21

6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione Chemical and Physical Properties

Names and Identifiers

    • 6-Methyl-2-p-tolyl-1,3,6,2-dioxazaborocane-4,8-dione
    • 4-Tolylboronic acid MIDA ester
    • 6-methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione
    • 4-Tolylboronic acid MIDA ester, 97%
    • E76510
    • SY316737
    • AKOS005166809
    • 1313758-93-8
    • AS-2864
    • DTXSID60678941
    • CS-0153084
    • 943552-01-0
    • 2-(4-Methylphenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
    • MFCD11215237
    • 6-Methyl-2-(p-tolyl)-1,3,6,2-dioxazaborocane-4,8-dione
    • DTXCID60629690
    • 6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione
    • MDL: MFCD11215237
    • Inchi: 1S/C12H14BNO4/c1-9-3-5-10(6-4-9)13-17-11(15)7-14(2)8-12(16)18-13/h3-6H,7-8H2,1-2H3
    • InChI Key: XXJWDGQXUAQEKD-UHFFFAOYSA-N
    • SMILES: O1B(C2C=CC(C)=CC=2)OC(CN(C)CC1=O)=O

Computed Properties

  • Exact Mass: 247.1015881g/mol
  • Monoisotopic Mass: 247.1015881g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 308
  • 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: 55.8?2

Experimental Properties

  • Melting Point: 197-202?°C

6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione Security Information

6-Methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane-4,8-dione Pricemore >>

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