2′-Fluoro[1,1′-biphenyl]-2-carboxaldehyde

C13H9FOCAS 223575-95-9200.21 g/mol

Open in Covalent MOL file
OF
AldehydeAryl halide

Properties

Molecular formula
C13H9FO
Molar mass
200.21 g/mol
Exact mass
200.0637 Da
logP
3.31Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
2

Hazards

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

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Identifiers

CAS number
223575-95-9
SMILES
O=Cc1ccccc1-c1ccccc1F
InChIKey
KKOOBRYMWSXJFU-UHFFFAOYSA-N
InChI
InChI=1S/C13H9FO/c14-13-8-4-3-7-12(13)11-6-2-1-5-10(11)9-15/h1-9H

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Names and synonyms

5 names
  • [1,1′-Biphenyl]-2-carboxaldehyde, 2′-fluoro-
  • 2-(2-Fluorophenyl)benzaldehyde
  • 2′-Fluorobiphenyl-2-carboxaldehyde
  • 2′-Fluoro-[1,1′-biphenyl]-2-carbaldehyde
  • 2'-Fluoro-[1,1'-biphenyl]-2-carbaldehyde

Work with 2′-Fluoro[1,1′-biphenyl]-2-carboxaldehyde

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

(1,1'-Biphenyl)-2,2'-dicarboxaldehyde1210-05-571 % similar 2-Fluorobenzaldehyde446-52-669 % similar 2,2'-Difluoro-1,1'-biphenyl388-82-958 % similar 2,3-Difluorobenzaldehyde2646-91-557 % similar [1,1′-Biphenyl]-2-carboxaldehyde1203-68-555 % similar 2-Chloro-3-fluorobenzaldehyde96516-31-355 % similar 3-Fluoro-2-methylbenzaldehyde147624-13-353 % similar 3-Fluorosalicylaldehyde394-50-353 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-(4-Fluorophenyl)benzaldehyde164334-74-1 2-(4-Fluorophenyl)benzaldehyde192863-46-0 2-Fluorobenzophenone342-24-5 3-Fluorobenzophenone345-69-7 4-Fluorobenzophenone345-83-5 3-(3-Fluorophenyl)benzaldehyde400750-09-6 3'-Fluoro-[1,1'-biphenyl]-4-carbaldehyde400750-63-2 2'-Fluorobiphenyl-4-carbaldehyde57592-42-4

Elsewhere

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