3,4-Difluorobenzaldehyde

C7H4F2OCAS 34036-07-2142.10 g/mol

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AldehydeAryl halide

Properties

Molecular formula
C7H4F2O
Molar mass
142.10 g/mol
Exact mass
142.0230 Da
logP
1.78Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
34036-07-2
SMILES
O=Cc1ccc(F)c(F)c1
InChIKey
JPHKMYXKNKLNDF-UHFFFAOYSA-N
InChI
InChI=1S/C7H4F2O/c8-6-2-1-5(4-10)3-7(6)9/h1-4H

Weigh it out

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

Names and synonyms

1 names
  • Benzaldehyde, 3,4-difluoro-

Work with 3,4-Difluorobenzaldehyde

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

3-Fluoro-4-iodobenzaldehyde1003709-57-664 % similar 4-Bromo-3-fluorobenzaldehyde133059-43-564 % similar 4-Fluoro-3-methylbenzaldehyde135427-08-664 % similar 3-Fluoro-4-methylbenzaldehyde177756-62-664 % similar 3-Chloro-4-fluorobenzaldehyde34328-61-564 % similar 3-Fluoro-4-hydroxybenzaldehyde405-05-064 % similar 4-Chloro-3-fluorobenzaldehyde5527-95-764 % similar 3-Bromo-4-fluorobenzaldehyde77771-02-964 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4-Difluorobenzaldehyde1550-35-2 2,5-Difluorobenzaldehyde2646-90-4 2,3-Difluorobenzaldehyde2646-91-5 3,5-Difluorobenzaldehyde32085-88-4 2,6-Difluorobenzaldehyde437-81-0

Elsewhere

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