1-Butane Boronic Acid

Status : experimental

Chemical Classification

This compound belongs to the class of organic compounds known as boronic acids. These are compounds comprising the boronic acid functional group RB(O)O (R,R’=alkyl,aryl).

Boronic acids

Organic compounds

Organic acids and derivatives

Boronic acid derivatives

Boronic acids

Calculated Property

kind Value Source
logP 0.68 ALOGPS
logS 0.09 ALOGPS
Water Solubility 1.26e+02 g/l ALOGPS
logP 1.17 ChemAxon
IUPAC Name butylboronic acid ChemAxon
Traditional IUPAC Name butylboronic acid ChemAxon
Molecular Weight 101.94 ChemAxon
Monoisotopic Weight 102.085210062 ChemAxon
Molecular Formula C4H11BO2 ChemAxon
InChI InChI=1S/C4H11BO2/c1-2-3-4-5(6)7/h6-7H,2-4H2,1H3 ChemAxon
Polar Surface Area (PSA) 40.46 ChemAxon
Refractivity 24.71 ChemAxon
Polarizability 12.21 ChemAxon
Rotatable Bond Count 3 ChemAxon
H Bond Acceptor Count 2 ChemAxon
H Bond Donor Count 2 ChemAxon
Physiological Charge 0 ChemAxon
Number of Rings 0 ChemAxon
Bioavailability 1 ChemAxon
Rule of Five 1 ChemAxon
Ghose Filter 0 ChemAxon
MDDR-Like Rule 0 ChemAxon

Target within organism

  • Bacterial leucyl aminopeptidase : in Vibrio proteolyticus