1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone

C14H10ClFO — CID 115504911

IUPAC1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1ccc(F)cc1Cl
InChIInChI=1S/C14H10ClFO/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(16)8-14(13)15/h2-8H,1H3
InChIKeyMEUKJTJFWMETNH-UHFFFAOYSA-N
MW248.68 g/mol
LogP4.35
Rot. Bonds2

About 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone

1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone (PubChem CID 115504911) has the molecular formula C14H10ClFO and a molecular weight of 248.68 g/mol. Its IUPAC name is 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone.

Molecular Properties

Compound Name1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone
PubChem CID115504911
Molecular FormulaC14H10ClFO
Molecular Weight248.68 g/mol
Exact Mass248.04
IUPAC Name1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1ccc(F)cc1Cl
InChIInChI=1S/C14H10ClFO/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(16)8-14(13)15/h2-8H,1H3
InChIKeyMEUKJTJFWMETNH-UHFFFAOYSA-N
XLogP4.35
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.68
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[2-(4-fluoro-2-methylphenyl)phenyl]ethanone
CID 54912608
1-[5-fluoro-2-(2-fluorophenyl)phenyl]ethanone
CID 22482354
(2,4-difluorophenyl)boronic acid;1-[2-(2,4-difluorophenyl)phenyl]ethanone
CID 68815126
1-[2-(2,4-difluorophenyl)-4-fluorophenyl]ethanone
CID 22482372
1-[2-(4-chloro-2,5-dimethylphenyl)-4-fluorophenyl]ethanone
CID 114068685
1-(2-chlorophenyl)ethanone;hydrochloride
CID 174743581
1-[4-(2-chloro-4-fluorophenyl)-3-nitrophenyl]ethanone
CID 21406810
acetic acid;1,2-dichloro-4-fluorobenzene
CID 174538740
1-[2-(2,3-dimethylphenyl)-4-fluorophenyl]ethanone
CID 114068433
1-[2-(2-ethenylphenyl)phenyl]ethanone
CID 102225851
(2-chloro-4-fluorophenyl)-(2-methoxyphenyl)methanone
CID 62946338
1-[5-fluoro-2-(2-fluoro-4-methylphenyl)phenyl]ethanone
CID 175647053

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone?
The IUPAC name of 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone (CID 115504911) is 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone.
What is the SMILES notation for 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone?
The canonical SMILES for 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone is CC(=O)c1ccccc1-c1ccc(F)cc1Cl.
What is the InChIKey of 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone?
The InChIKey is MEUKJTJFWMETNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFO/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(16)8-14(13)15/h2-8H,1H3.
What are the key properties of 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone?
1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone has a molecular weight of 248.68 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-chloro-4-fluorophenyl)phenyl]ethanone is sourced from PubChem (CID 115504911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).