Cas no 851137-35-4 (Hexan-3-ylboronic acid)

Hexan-3-ylboronic acid structure
Hexan-3-ylboronic acid structure
Product Name:Hexan-3-ylboronic acid
CAS No:851137-35-4
MF:C6H15BO2
MW:129.993102312088
CID:2851892
Update Time:2023-08-09

Hexan-3-ylboronic acid Chemical and Physical Properties

Names and Identifiers

    • hexan-3-ylboronic acid
    • Hexan-3-ylboronic acid
    • Inchi: 1S/C6H15BO2/c1-3-5-6(4-2)7(8)9/h6,8-9H,3-5H2,1-2H3
    • InChI Key: MADOAEPFTAYMEJ-UHFFFAOYSA-N
    • SMILES: OB(C(CC)CCC)O

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 66.1
  • Topological Polar Surface Area: 40.5
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