chempirical

2-Fluoro-6-methylbenzaldehyde

C8H7FOCAS 117752-04-2138.14 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

Identifiers

CAS number
117752-04-2
SMILES
CC1=C(C(=CC=C1)F)C=O
InChIKey
BGQBJWPZBBMKEI-UHFFFAOYSA-N
InChI
InChI=1S/C8H7FO/c1-6-3-2-4-8(9)7(6)5-10/h2-5H,1H3

Weigh it out

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

Work with 2-Fluoro-6-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

2,6-Dimethylbenzaldehyde1123-56-469 % similar 2,6-Difluorobenzaldehyde437-81-069 % similar 2-Chloro-6-fluoro-3-methylbenzaldehyde104451-99-266 % similar 2-Chloro-6-methylbenzaldehyde1194-64-558 % similar 2-Chloro-6-fluorobenzaldehyde387-45-158 % similar 2-Chloro-3,6-difluorobenzaldehyde261762-39-455 % similar B-(3-Fluoro-2-formylphenyl)boronic acid871126-15-751 % similar 1,2-Difluoro-3-methylbenzene3828-49-750 % similar

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

Same formula

(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 4′-Fluoroacetophenone403-42-9

Elsewhere

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