2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone

C15H11F3O — CID 62622276

IUPAC2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)Cc2cccc(F)c2F)cc1F
InChIInChI=1S/C15H11F3O/c1-9-5-6-10(7-13(9)17)14(19)8-11-3-2-4-12(16)15(11)18/h2-7H,8H2,1H3
InChIKeyAFWPMXVWJSCBNN-UHFFFAOYSA-N
MW264.25 g/mol
LogP3.84
Rot. Bonds3

About 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone

2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone (PubChem CID 62622276) has the molecular formula C15H11F3O and a molecular weight of 264.25 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
PubChem CID62622276
Molecular FormulaC15H11F3O
Molecular Weight264.25 g/mol
Exact Mass264.08
IUPAC Name2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)Cc2cccc(F)c2F)cc1F
InChIInChI=1S/C15H11F3O/c1-9-5-6-10(7-13(9)17)14(19)8-11-3-2-4-12(16)15(11)18/h2-7H,8H2,1H3
InChIKeyAFWPMXVWJSCBNN-UHFFFAOYSA-N
XLogP3.84
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-chloro-2-fluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 102857168
2-(2-bromophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 54919565
2-(3-chloro-2-fluorophenyl)-1-(4-fluoro-3-methylphenyl)ethanone
CID 82801937
1-(3-chloro-4-fluorophenyl)-2-(2,3-difluorophenyl)ethanone
CID 63093654
2-(3-chloro-2-fluorophenyl)-1-(3,4-dimethylphenyl)ethanone
CID 82802493
2-(2,5-dichlorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 65317110
2-(2-bromo-3-fluorophenyl)-1-(3-chloro-4-methylphenyl)ethanone
CID 115790146
2-(2,3-difluorophenyl)-1-(2,6-difluorophenyl)ethanone
CID 79522311
2-(4-bromophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 60797592
1-[4-(2-aminoethyl)phenyl]-2-(2,3-difluorophenyl)ethanone
CID 116577788
2-(4-aminophenyl)-1-(3-fluoro-4-methylphenyl)ethanone
CID 107129670
1-(2,5-dibromo-4-methylphenyl)-2-(2,3-difluorophenyl)ethanone
CID 81473471

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The IUPAC name of 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone (CID 62622276) is 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone.
What is the SMILES notation for 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The canonical SMILES for 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone is Cc1ccc(C(=O)Cc2cccc(F)c2F)cc1F.
What is the InChIKey of 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
The InChIKey is AFWPMXVWJSCBNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3O/c1-9-5-6-10(7-13(9)17)14(19)8-11-3-2-4-12(16)15(11)18/h2-7H,8H2,1H3.
What are the key properties of 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone?
2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone has a molecular weight of 264.25 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-1-(3-fluoro-4-methylphenyl)ethanone is sourced from PubChem (CID 62622276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).