Cas no 109674-45-5 (2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione)

2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione structure
109674-45-5 structure
Product Name:2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
CAS No:109674-45-5
MF:C11H12BNO4
MW:233.028283119202
CID:2886917
PubChem ID:13600893
Update Time:2024-11-06

2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione Chemical and Physical Properties

Names and Identifiers

    • 6-Methyl-2-phenyl-1,3,6,2-dioxazaborocane-4,8-dione
    • 2-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
    • 4H-1,3,6,2-Dioxazaborocine-4,8(5H)-dione, dihydro-6-methyl-2-phenyl-
    • C11H12BNO4
    • AMTB473
    • AMY17938
    • 1892AA
    • Phenylboronic acid MIDA ester, 95%
    • A921846
    • Phenylboronic acid (3-methyl-1,5-dioxo-3-azapentane-1,5-diyl) ester
    • AKOS016012093
    • AISHCGVNWMRLOM-UHFFFAOYSA-N
    • Phenylboronic acid MIDA ester
    • 109674-45-5
    • CS-0329651
    • AS-2537
    • DB-263944
    • DTXSID50544762
    • MFCD11215250
    • 109737-57-7
    • SCHEMBL15669689
    • Inchi： 1S/C11H12BNO4/c1-13-7-10(14)16-12(17-11(15)8-13)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
    • InChI Key： AISHCGVNWMRLOM-UHFFFAOYSA-N
    • SMILES： O1B(C2C=CC=CC=2)OC(CN(C)CC1=O)=O

Computed Properties

  • Exact Mass: 233.0859380g/mol
  • Monoisotopic Mass: 233.0859380g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 284
  • 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-Phenyl-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione Pricemore >>

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Chemenu
CM430299-5g
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Chemenu
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