Cas no 944483-39-0 ([3-(diethylaminomethyl)phenyl]boronic acid)

[3-(diethylaminomethyl)phenyl]boronic acid structure
944483-39-0 structure
Product Name:[3-(diethylaminomethyl)phenyl]boronic acid
CAS No:944483-39-0
MF:C11H18BNO2
MW:207.077123165131
MDL:MFCD14687157
CID:1057130
PubChem ID:46785457
Update Time:2025-04-20

[3-(diethylaminomethyl)phenyl]boronic acid Chemical and Physical Properties

Names and Identifiers

    • 3-[(Diethylamino)methyl]phenylboronic Acid
    • (3-((Diethylamino)methyl)phenyl)boronic acid
    • {3-[(Diethylamino)methyl]phenyl}boronic acid
    • 3-(Diethylamino)methylphenylboronic acid
    • [3-(diethylaminomethyl)phenyl]boronic acid
    • 5752AJ
    • AM87472
    • SY019884
    • SB78529
    • 944483-39-0
    • AKOS010796038
    • A859418
    • AS-55376
    • MFCD14687157
    • (3-((diethylamino)methyl)phenyl)boronicacid
    • CS-0176006
    • I12209
    • DB-252222
    • MDL: MFCD14687157
    • Inchi: 1S/C11H18BNO2/c1-3-13(4-2)9-10-6-5-7-11(8-10)12(14)15/h5-8,14-15H,3-4,9H2,1-2H3
    • InChI Key: LVIMXKVETPNUMR-UHFFFAOYSA-N
    • SMILES: OB(C1=CC=CC(=C1)CN(CC)CC)O

Computed Properties

  • Exact Mass: 207.1430590g/mol
  • Monoisotopic Mass: 207.1430590g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 174
  • 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: 43.7

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