1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone

C15H13FO — CID 54912273

IUPAC1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1ccc(F)c(C)c1
InChIInChI=1S/C15H13FO/c1-10-9-12(7-8-15(10)16)14-6-4-3-5-13(14)11(2)17/h3-9H,1-2H3
InChIKeyZPGHRCFJJZPZNY-UHFFFAOYSA-N
MW228.27 g/mol
LogP4.00
Rot. Bonds2

About 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone

1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone (PubChem CID 54912273) has the molecular formula C15H13FO and a molecular weight of 228.27 g/mol. Its IUPAC name is 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone.

Molecular Properties

Compound Name1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone
PubChem CID54912273
Molecular FormulaC15H13FO
Molecular Weight228.27 g/mol
Exact Mass228.10
IUPAC Name1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone
SMILESCC(=O)c1ccccc1-c1ccc(F)c(C)c1
InChIInChI=1S/C15H13FO/c1-10-9-12(7-8-15(10)16)14-6-4-3-5-13(14)11(2)17/h3-9H,1-2H3
InChIKeyZPGHRCFJJZPZNY-UHFFFAOYSA-N
XLogP4.00
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-acetylphenyl)-2-fluorobenzoic acid
CID 70699728
4-(2-acetylphenyl)-2-fluorobenzoate
CID 86307867
1-[2-chloro-4-(4-fluoro-3-methylphenyl)phenyl]ethanone
CID 82769801
1-[2-(4-fluoro-2-methylphenyl)phenyl]ethanone
CID 54912608
2-(4-fluoro-3-methylphenyl)benzaldehyde
CID 61025610
1-[4-(2-acetylphenyl)phenyl]ethanone
CID 11207145
1-[4-(2-chlorophenyl)-2-methylphenyl]ethanone
CID 172646458
methyl 2-(3-fluoro-4-methylphenyl)benzoate
CID 15129923
1,2-difluoro-3-(4-fluoro-3-methylphenyl)benzene
CID 134627237
1-[2-(3-amino-4-sulfanylphenyl)phenyl]ethanone
CID 139776798
1-[2-[4-[4-(2-acetylphenyl)-N-[4-(2-acetylphenyl)phenyl]anilino]phenyl]phenyl]ethanone
CID 122435887
1-[4-(4-fluoro-3-methylphenyl)-6-methylpyrimidin-2-yl]ethanone
CID 116895335

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone?
The IUPAC name of 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone (CID 54912273) is 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone.
What is the SMILES notation for 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone?
The canonical SMILES for 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone is CC(=O)c1ccccc1-c1ccc(F)c(C)c1.
What is the InChIKey of 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone?
The InChIKey is ZPGHRCFJJZPZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO/c1-10-9-12(7-8-15(10)16)14-6-4-3-5-13(14)11(2)17/h3-9H,1-2H3.
What are the key properties of 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone?
1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone has a molecular weight of 228.27 g/mol, XLogP of 4.00, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluoro-3-methylphenyl)phenyl]ethanone is sourced from PubChem (CID 54912273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).