Cas no 701261-35-0 (Neopentylboronic acid)

Neopentylboronic acid structure
Neopentylboronic acid structure
Product Name:Neopentylboronic acid
CAS No:701261-35-0
MF:C5H13BO2
MW:115.966521978378
MDL:MFCD09750464
CID:819886
PubChem ID:16218386
Update Time:2025-08-03

Neopentylboronic acid Chemical and Physical Properties

Names and Identifiers

    • NEOPENTYLBORONIC ACID
    • Neopentylboronic aci
    • 2,2-Dimethylpropylboronic acid
    • 2,2-Dimethylproppylboronic acid
    • (2,2-Dimethylpropyl)boronic acid
    • Boronic acid, (2,2-dimethylpropyl)-
    • Neopentylboronic acid, >=95%
    • AB51406
    • AK175287
    • AKOS025405134
    • CS-0063198
    • EN300-261418
    • AS-55556
    • AMY054
    • 701261-35-0
    • SY066938
    • ZB0609
    • C5H13BO2
    • SCHEMBL1453209
    • FT-0760595
    • DTXSID90584920
    • MFCD09750464
    • A866673
    • Neopentylboronicacid
    • DB-074260
    • Neopentylboronic acid
    • MDL: MFCD09750464
    • Inchi: 1S/C5H13BO2/c1-5(2,3)4-6(7)8/h7-8H,4H2,1-3H3
    • InChI Key: VCPOZKMTAGEGOT-UHFFFAOYSA-N
    • SMILES: OB(CC(C)(C)C)O

Computed Properties

  • Exact Mass: 116.10100
  • Monoisotopic Mass: 116.1008598g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 2
  • Complexity: 65.3
  • 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: 40.5

Experimental Properties

  • Melting Point: 85-89?°C
  • PSA: 40.46000
  • LogP: 0.50530

Neopentylboronic acid Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Storage Condition:2-8°C

Neopentylboronic acid Pricemore >>

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