5-Bromo-2-furaldehyde

C₅H₃BrO₂CAS 1899-24-7174.98 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₅H₃BrO₂
Molar mass: 174.98 g/mol
Exact mass: 173.9316 Da
logP: 1.85Crippen estimate
Polar surface area: 30.2 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Identifiers

CAS number

1899-24-7

SMILES

C1=C(OC(=C1)Br)C=O

InChIKey

WJTFHWXMITZNHS-UHFFFAOYSA-N

InChI

InChI=1S/C5H3BrO2/c6-5-2-1-4(3-7)8-5/h1-3H

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Names and synonyms

1 names

5-Bromofuran-2-carbaldehyde

Work with 5-Bromo-2-furaldehyde

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-Furandicarboxaldehyde823-82-564 % similar 5-Ethyl-2-furaldehyde23074-10-445 % similar 5-Nitrofurfural698-63-542 % similar Sodium 5-formyl-2-furansulfonate31795-44-540 % similar 5-(2-Chlorophenyl)-2-furancarboxaldehyde34035-04-640 % similar 5-(3-Chlorophenyl)-2-furancarboxaldehyde22078-59-738 % similar 2-Benzofurancarboxaldehyde4265-16-136 % similar 5-Bromo-2-furancarboxylic acid585-70-636 % similar

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

Same formula

3-Bromo-2-formylfuran14757-78-9 4-Bromo-2-furaldehyde21921-76-6

Elsewhere

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