chempirical

2-Fluoro-5-methylbenzaldehyde

C8H7FOCAS 93249-44-6138.14 g/mol

Open in Covalent MOL file
FO
AldehydeAryl halide

Properties

Molecular formula
C8H7FO
Molar mass
138.14 g/mol
Exact mass
138.0481 Da
logP
1.95Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
93249-44-6
SMILES
CC1=CC(=C(C=C1)F)C=O
InChIKey
QAWILFXCNRBMDF-UHFFFAOYSA-N
InChI
InChI=1S/C8H7FO/c1-6-2-3-8(9)7(4-6)5-10/h2-5H,1H3

Weigh it out

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

Work with 2-Fluoro-5-methylbenzaldehyde

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-Difluorobenzaldehyde2646-90-460 % similar 2,5-Dimethylbenzaldehyde5779-94-260 % similar 2-Fluoro-5-iodobenzaldehyde146137-76-056 % similar 5-Methylsalicylaldehyde613-84-356 % similar 2-Bromo-5-methylbenzaldehyde90221-55-956 % similar 5-Bromo-2-fluorobenzaldehyde93777-26-556 % similar 5-Chloro-2-fluorobenzaldehyde96515-79-656 % similar 2-Fluoro-5-methoxybenzaldehyde105728-90-356 % similar

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

Same formula

2-Fluoro-6-methylbenzaldehyde117752-04-2 (R)-(4-Fluorophenyl)oxirane134356-73-3 4-Fluoro-3-methylbenzaldehyde135427-08-6 2-Fluoro-4-methylbenzaldehyde146137-80-6 3-Fluoro-2-methylbenzaldehyde147624-13-3 3-Fluoro-4-methylbenzaldehyde177756-62-6 2-(4-Fluorophenyl)oxirane18511-62-1 3-Fluoro-5-methylbenzaldehyde189628-39-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook