2-Formylfuran-5-boronic acid

C₅H₅BO₄CAS 27329-70-0139.90 g/mol

Open in Covalent MOL file

Aldehyde Boronic acid

Properties

Molecular formula: C₅H₅BO₄
Molar mass: 139.90 g/mol
Exact mass: 140.0281 Da
logP: -1.23Crippen estimate
Polar surface area: 70.7 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 2

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

27329-70-0

SMILES

B(C1=CC=C(O1)C=O)(O)O

InChIKey

JUWYQISLQJRRNT-UHFFFAOYSA-N

InChI

InChI=1S/C5H5BO4/c7-3-4-1-2-5(10-4)6(8)9/h1-3,8-9H

Weigh it out

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

Names and synonyms

1 names

5-Formylfuran-2-boronic acid

Work with 2-Formylfuran-5-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

2,5-Furandicarboxaldehyde823-82-556 % similar 5-Chloro-2-furaldehyde21508-19-050 % similar 5-Iodo-2-furancarboxaldehyde2689-65-850 % similar Hydroxymethylfurfural67-47-045 % similar 5-Bromo-2-furaldehyde1899-24-745 % similar 5-Methylfurfural620-02-045 % similar 5-Methyl-2-furanboronic Acid62306-79-045 % similar 5-Formyl-2-furancarboxylic acid13529-17-443 % similar

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

Same formula

3-Formylfuran-2-boronic acid27339-38-4 B-(5-Formyl-3-furanyl)boronic acid62306-80-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook