3,5-Dibromobenzaldehyde

C₇H₄Br₂OCAS 56990-02-4263.92 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₇H₄Br₂O
Molar mass: 263.92 g/mol
Exact mass: 261.8629 Da
Melting point: 90 °C
logP: 3.02Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Identifiers

CAS number

56990-02-4

SMILES

O=Cc1cc(Br)cc(Br)c1

InChIKey

ZLDMZIXUGCGKMB-UHFFFAOYSA-N

InChI

InChI=1S/C7H4Br2O/c8-6-1-5(4-10)2-7(9)3-6/h1-4H

Weigh it out

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

Names and synonyms

1 names

Benzaldehyde, 3,5-dibromo-

Work with 3,5-Dibromobenzaldehyde

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

5-Bromoisophthalaldehyde120173-41-389 % similar 3-Bromo-5-chlorobenzaldehyde188813-05-068 % similar 4-Bromobenzaldehyde1122-91-464 % similar 3-Bromo-5-methoxybenzaldehyde262450-65-761 % similar 3-Bromobenzaldehyde3132-99-860 % similar 5-Bromo-3-pyridinecarboxaldehyde113118-81-358 % similar 3,5-Dihydroxybenzaldehyde26153-38-850 % similar 3,5-Dibromo-4-hydroxybenzaldehyde2973-77-548 % similar

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

Elsewhere

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