chempirical

Ethylboronic acid

C2H7BO2CAS 4433-63-073.89 g/mol

Open in Covalent MOL file
BOHHO
Boronic acid

Properties

Molecular formula
C2H7BO2
Molar mass
73.89 g/mol
Exact mass
74.0539 Da
logP
-0.52Crippen estimate
Polar surface area
40.5 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
4433-63-0
SMILES
B(CC)(O)O
InChIKey
PAVZHTXVORCEHP-UHFFFAOYSA-N
InChI
InChI=1S/C2H7BO2/c1-2-3(4)5/h4-5H,2H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Ethylboronic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

B-Propylboronic acid17745-45-844 % similar Butylboronic acid4426-47-540 % similar Triethylborane97-94-940 % similar B-Pentylboronic acid4737-50-238 % similar Hexylboronic Acid (contains varying amounts of Anhydride)16343-08-136 % similar Decylboronic acid24464-63-936 % similar B-Octylboronic acid28741-08-436 % similar 2-Methylpropylboronic acid84110-40-735 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook