Cas no 1072952-40-9 (3-Picoline-4-boronic Acid Hydrochloride)

3-Picoline-4-boronic Acid Hydrochloride structure
1072952-40-9 structure
Product Name:3-Picoline-4-boronic Acid Hydrochloride
CAS No:1072952-40-9
MF:C6H9BClNO2
MW:173.405160665512
MDL:MFCD06659519
CID:839998
PubChem ID:46739017
Update Time:2025-04-19

3-Picoline-4-boronic Acid Hydrochloride Chemical and Physical Properties

Names and Identifiers

    • (3-Methylpyridin-4-yl)boronic acid hydrochloride
    • 3-methylpyridin-4-ylboronic acid
    • 3-METHYLPYRIDINE-4-BORONIC ACID
    • 3-Picoline-4-boronic acid HCl
    • Boronic acid, B-(3-methyl-4-pyridinyl)-, hydrochloride (1:1)
    • (3-methyl-4-pyridinyl)boronic acid hydrochloride
    • 3-Picoline-4-boronic acid hydrochloride
    • A-4780
    • (3-methylpyridin-4-yl)boronic acid;hydrochloride
    • MFCD06659519
    • NGOUFMIMHSRFGU-UHFFFAOYSA-N
    • 3-picoline-4-boronicacidhcl
    • 3-picoline-4-boronic acid hydrochloride salt
    • (3-Methylpyridin-4-yl)boronic acid--hydrogen chloride (1/1)
    • Z3234879019
    • AKOS015891804
    • DTXSID70674656
    • SCHEMBL14797240
    • BS-22520
    • CS-0175864
    • EN300-7379733
    • AT14590
    • (3-methyl-4-pyridinyl)boronic acid HCl
    • 3-METHYLPYRIDIN-4-YLBORONIC ACID HYDROCHLORIDE
    • 1072952-40-9
    • 3-Picoline-4-boronic Acid Hydrochloride
    • MDL: MFCD06659519
    • Inchi: 1S/C6H8BNO2.ClH/c1-5-4-8-3-2-6(5)7(9)10;/h2-4,9-10H,1H3;1H
    • InChI Key: NGOUFMIMHSRFGU-UHFFFAOYSA-N
    • SMILES: Cl.OB(C1C=CN=CC=1C)O

Computed Properties

  • Exact Mass: 173.04100
  • Monoisotopic Mass: 173.0414864g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 110
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 53.4?2

Experimental Properties

  • PSA: 53.35000
  • LogP: -0.12820

3-Picoline-4-boronic Acid Hydrochloride Security Information

  • Hazard Category Code: 22
  • Hazardous Material Identification: Xn

3-Picoline-4-boronic Acid Hydrochloride Pricemore >>

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abcr
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