Furan-2-boronic acid

C₄H₅BO₃CAS 13331-23-2111.89 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₅BO₃
Molar mass: 111.89 g/mol
Exact mass: 112.0332 Da
logP: -1.04Crippen estimate
Polar surface area: 53.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Identifiers

CAS number

13331-23-2

SMILES

B(C1=CC=CO1)(O)O

InChIKey

PZJSZBJLOWMDRG-UHFFFAOYSA-N

InChI

InChI=1S/C4H5BO3/c6-5(7)4-2-1-3-8-4/h1-3,6-7H

Weigh it out

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

Names and synonyms

1 names

2-Furanboronic acid

Work with Furan-2-boronic 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

Phenylboronic acid98-80-636 % similar 2-Methoxyfuran25414-22-636 % similar 2-Thienylboronic acid6165-68-036 % similar Furfuryl alcohol98-00-036 % similar 2-Methylfuran534-22-535 % similar α-Methyl-2-furanmethanol4208-64-433 % similar (4-Hydroxyphenyl)boronic acid71597-85-833 % similar (3-Hydroxyphenyl)boronic acid87199-18-633 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook