2-Fluoro-5-methoxybenzaldehyde

C₈H₇FO₂CAS 105728-90-3154.14 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Ether

Properties

Molecular formula: C₈H₇FO₂
Molar mass: 154.14 g/mol
Exact mass: 154.0430 Da
Melting point: 48–50 °C
logP: 1.65Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Identifiers

CAS number

105728-90-3

SMILES

COc1ccc(F)c(C=O)c1

InChIKey

DKIQXHIAEMGZGO-UHFFFAOYSA-N

InChI

InChI=1S/C8H7FO2/c1-11-7-2-3-8(9)6(4-7)5-10/h2-5H,1H3

Weigh it out

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

Names and synonyms

1 names

Benzaldehyde, 2-fluoro-5-methoxy-

Work with 2-Fluoro-5-methoxybenzaldehyde

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-Dimethoxybenzaldehyde93-02-766 % similar 2-Fluoro-5-(trifluoromethoxy)benzaldehyde886497-81-061 % similar 2-Hydroxy-5-methoxybenzaldehyde672-13-960 % similar 2,4-Dimethoxybenzaldehyde613-45-659 % similar 1,2-Difluoro-4-methoxybenzene115144-40-658 % similar 2-Hydroxy-4-methoxybenzaldehyde673-22-357 % similar 2,5-Difluoro-4-methoxybenzaldehyde879093-08-057 % similar 4-Methoxy-2-(trifluoromethyl)benzaldehyde106312-36-155 % similar

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

Same formula

2-Fluoro-3-methoxybenzaldehyde103438-88-6 4-Fluoro-3-methoxybenzaldehyde128495-46-5 2-Fluoro-6-methoxybenzaldehyde146137-74-8 1-(4-Fluoro-2-hydroxyphenyl)ethanone1481-27-2 α-Fluorobenzeneacetic acid1578-63-8 5-Fluoro-2-methoxybenzaldehyde19415-51-1 3-Fluorophenylacetic acid331-25-9 2-Fluoro-4-methoxybenzaldehyde331-64-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook