1-(4-Fluorophenyl)-2-phenylethan-1-one

C₁₄H₁₁FOCAS 347-84-2214.24 g/mol

Open in Covalent MOL file

Aryl halide Ketone

Properties

Molecular formula: C₁₄H₁₁FO
Molar mass: 214.24 g/mol
Exact mass: 214.0794 Da
logP: 3.25Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

347-84-2

SMILES

C1=CC=C(C=C1)CC(=O)C2=CC=C(C=C2)F

InChIKey

YFYKGCQUWKAFLW-UHFFFAOYSA-N

InChI

InChI=1S/C14H11FO/c15-13-8-6-12(7-9-13)14(16)10-11-4-2-1-3-5-11/h1-9H,10H2

Weigh it out

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

Names and synonyms

1 names

1-(4-Fluorophenyl)-2-phenyl-ethanone

Work with 1-(4-Fluorophenyl)-2-phenylethan-1-one

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-Phenylacetophenone451-40-171 % similar 1-(4-Chlorophenyl)-2-phenylethanone1889-71-064 % similar 1-(4-Bromophenyl)-2-phenylethanone2001-29-864 % similar 2-Amino-4'-fluoroacetophenone369-43-759 % similar 4'-Methoxy-2-phenylacetophenone1023-17-258 % similar 2-Bromo-1-(4-fluorophenyl)ethan-1-one403-29-255 % similar 1-(4-Fluorophenyl)-2-hydroxyethanone403-31-655 % similar 1-(4-Fluorophenyl)-1-propanone456-03-155 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Fluoro-4'-methylbenzophenone530-46-1

Elsewhere

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