4-[(4-Bromophenyl)methoxy]benzaldehyde

C₁₄H₁₁BrO₂CAS 149833-95-4291.14 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Ether

Properties

Molecular formula: C₁₄H₁₁BrO₂
Molar mass: 291.14 g/mol
Exact mass: 289.9942 Da
logP: 3.84Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 4

Identifiers

CAS number

149833-95-4

SMILES

O=Cc1ccc(OCc2ccc(Br)cc2)cc1

InChIKey

HGCGRPJQAXHMMI-UHFFFAOYSA-N

InChI

InChI=1S/C14H11BrO2/c15-13-5-1-12(2-6-13)10-17-14-7-3-11(9-16)4-8-14/h1-9H,10H2

Weigh it out

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

Names and synonyms

2 names

Benzaldehyde, 4-[(4-bromophenyl)methoxy]-
4-(4-Bromobenzyloxy)benzaldehyde

Work with 4-[(4-Bromophenyl)methoxy]benzaldehyde

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

4-(Benzyloxy)benzaldehyde4397-53-968 % similar 4-[(4-Fluorophenyl)methoxy]benzaldehyde56442-17-267 % similar 4-Bromobenzaldehyde1122-91-460 % similar 1-(Benzyloxy)-4-bromobenzene6793-92-659 % similar 4-[(3-Fluorophenyl)methoxy]benzaldehyde66742-57-254 % similar 4-Ethoxybenzaldehyde10031-82-050 % similar 3,5-Dibenzyloxybenzaldehyde14615-72-649 % similar 4-[(2-Fluorophenyl)methoxy]benzaldehyde70627-20-248 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook