4'-Fluorobiphenyl-4-carbaldehyde

C13H9FOCAS 60992-98-5200.21 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

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number
60992-98-5
SMILES
C1=CC(=CC=C1C=O)C2=CC=C(C=C2)F
InChIKey
ZVMXCNFUJPLQFT-UHFFFAOYSA-N
InChI
InChI=1S/C13H9FO/c14-13-7-5-12(6-8-13)11-3-1-10(9-15)2-4-11/h1-9H

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Names and synonyms

1 names
  • 4'-Fluoro-(1,1'-biphenyl)-4-carbaldehyde

Work with 4'-Fluorobiphenyl-4-carbaldehyde

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

4-Fluorobenzaldehyde459-57-486 % similar [1,1′-Biphenyl]-4,4′-dicarboxaldehyde66-98-871 % similar 4-(4-Fluorophenoxy)benzaldehyde137736-06-267 % similar 1,3,5-Tris(4-formylphenyl)benzene118688-53-263 % similar [1,1′-Biphenyl]-4-carboxaldehyde3218-36-860 % similar 4,4′-Difluorobiphenyl398-23-257 % similar 1,4-Benzenedicarboxaldehyde623-27-857 % similar 4',4''',4''''',4'''''''-(Ethene-1,1,2,2-tetrayl)tetrakis(([1,1'-biphenyl]-4-carbaldehyde))1624970-54-256 % 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′-Fluoro[1,1′-biphenyl]-2-carboxaldehyde223575-95-9 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

Elsewhere

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