1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone

C15H12ClFO — CID 105373147

IUPAC1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
SMILESCc1ccc(F)cc1CC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H12ClFO/c1-10-2-7-14(17)8-12(10)9-15(18)11-3-5-13(16)6-4-11/h2-8H,9H2,1H3
InChIKeyXMWXQJYBJREPFA-UHFFFAOYSA-N
MW262.71 g/mol
LogP4.21
Rot. Bonds3

About 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone

1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone (PubChem CID 105373147) has the molecular formula C15H12ClFO and a molecular weight of 262.71 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
PubChem CID105373147
Molecular FormulaC15H12ClFO
Molecular Weight262.71 g/mol
Exact Mass262.06
IUPAC Name1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
SMILESCc1ccc(F)cc1CC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C15H12ClFO/c1-10-2-7-14(17)8-12(10)9-15(18)11-3-5-13(16)6-4-11/h2-8H,9H2,1H3
InChIKeyXMWXQJYBJREPFA-UHFFFAOYSA-N
XLogP4.21
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.71
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-bromophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373145
1-(4-ethylphenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105373157
2-(2-chloro-5-fluorophenyl)-1-(4-chlorophenyl)ethanone
CID 102617587
2-(5-fluoro-2-methylphenyl)-1-pyridin-4-ylethanone
CID 105373154
2-(2,5-dimethylphenyl)-1-(4-fluorophenyl)ethanone
CID 54958156
1-(3-bromo-4-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105376772
2-(5-fluoro-2-methylphenyl)-1-thiophen-3-ylethanone
CID 105373155
2-(5-fluoro-2-methylphenyl)-1-(2-fluorophenyl)ethanone
CID 105373215
2-(2,5-dimethylphenyl)-1-(4-fluoro-3-methylphenyl)ethanone
CID 55186589
2-(4-chloro-2-fluorophenyl)-1-(4-chlorophenyl)ethanone
CID 114853604
2-(2,5-dichlorophenyl)-1-(4-fluorophenyl)ethanone
CID 65316679
2-(2,5-difluorophenyl)-1-[4-(dimethylamino)phenyl]ethanone
CID 105082380

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The IUPAC name of 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone (CID 105373147) is 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone.
What is the SMILES notation for 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The canonical SMILES for 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone is Cc1ccc(F)cc1CC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
The InChIKey is XMWXQJYBJREPFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFO/c1-10-2-7-14(17)8-12(10)9-15(18)11-3-5-13(16)6-4-11/h2-8H,9H2,1H3.
What are the key properties of 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone?
1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone has a molecular weight of 262.71 g/mol, XLogP of 4.21, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone is sourced from PubChem (CID 105373147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).