1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone

C15H13FO2 — CID 57364040

IUPAC1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone
SMILESCC(=O)c1ccccc1OC(F)c1ccccc1
InChIInChI=1S/C15H13FO2/c1-11(17)13-9-5-6-10-14(13)18-15(16)12-7-3-2-4-8-12/h2-10,15H,1H3
InChIKeyVTHMARPOMHALBY-UHFFFAOYSA-N
MW244.27 g/mol
LogP3.94
Rot. Bonds4

About 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone

1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone (PubChem CID 57364040) has the molecular formula C15H13FO2 and a molecular weight of 244.27 g/mol. Its IUPAC name is 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone.

Molecular Properties

Compound Name1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone
PubChem CID57364040
Molecular FormulaC15H13FO2
Molecular Weight244.27 g/mol
Exact Mass244.09
IUPAC Name1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone
SMILESCC(=O)c1ccccc1OC(F)c1ccccc1
InChIInChI=1S/C15H13FO2/c1-11(17)13-9-5-6-10-14(13)18-15(16)12-7-3-2-4-8-12/h2-10,15H,1H3
InChIKeyVTHMARPOMHALBY-UHFFFAOYSA-N
XLogP3.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.27
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-acetylphenyl) 2,2-diphenylacetate
CID 134840846
3-(2-acetylphenoxy)butan-2-one
CID 82312052
2-hydroxy-2-phenyl-1-[2-(1-phenylethoxy)phenyl]ethanone
CID 175347432
2-amino-2-phenyl-1-(2-propan-2-yloxyphenyl)ethanone
CID 116551128
(2-acetylphenyl) methyl carbonate
CID 14493761
carbonic acid;bis(2-propan-2-yloxybenzoic acid)
CID 66629297
benzyl 2-(2-acetylphenoxy)propanoate
CID 82312028
1-[2-[2-(1-phenylethoxy)ethoxy]phenyl]ethanone
CID 62031613
1-[3-(difluoromethoxy)-2-methylphenyl]ethanone
CID 70867743
3-[2-(difluoromethoxy)phenyl]-2-fluorobut-2-enoic acid
CID 79728817
1-[2-[(2R)-1-(dimethylamino)propan-2-yl]oxyphenyl]ethanone
CID 129322733
formaldehyde;bis(1-(2-methoxyphenyl)ethanone)
CID 174959963

Frequently Asked Questions

What is the IUPAC name of 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone?
The IUPAC name of 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone (CID 57364040) is 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone.
What is the SMILES notation for 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone?
The canonical SMILES for 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone is CC(=O)c1ccccc1OC(F)c1ccccc1.
What is the InChIKey of 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone?
The InChIKey is VTHMARPOMHALBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO2/c1-11(17)13-9-5-6-10-14(13)18-15(16)12-7-3-2-4-8-12/h2-10,15H,1H3.
What are the key properties of 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone?
1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone has a molecular weight of 244.27 g/mol, XLogP of 3.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[fluoro(phenyl)methoxy]phenyl]ethanone is sourced from PubChem (CID 57364040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).