2-Fluoro-5-methoxybenzaldehyde

C8H7FO2CAS 105728-90-3154.14 g/mol

Open in Covalent MOL file
OFO
AldehydeAryl halideEther

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 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 50 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

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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-Fluoro-4-methoxybenzaldehyde331-64-675 % similar 2,5-Dimethoxybenzaldehyde93-02-766 % similar 2-Fluoro-4,5-dimethoxybenzaldehyde71924-62-464 % similar 2-Fluoro-5-(trifluoromethoxy)benzaldehyde886497-81-061 % similar 2,6-Difluoro-4-methoxybenzaldehyde256417-10-461 % similar 2-Hydroxy-5-methoxybenzaldehyde672-13-960 % similar 2-Bromo-5-methoxybenzaldehyde7507-86-060 % similar 4,5-Difluoro-2-methoxybenzaldehyde145742-34-359 % 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 4'-Fluoro-2'-hydroxyacetophenone1481-27-2 Fluorophenylacetic acid1578-63-8 5-Fluoro-2-methoxybenzaldehyde19415-51-1 2-Fluoro-3-methylbenzoic acid315-31-1 2-Fluoro-5-methylbenzoic acid321-12-0

Elsewhere

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