2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone

C16H14F2O3 — CID 63269700

IUPAC2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone
SMILESCCOc1ccccc1C(=O)COc1cc(F)ccc1F
InChIInChI=1S/C16H14F2O3/c1-2-20-15-6-4-3-5-12(15)14(19)10-21-16-9-11(17)7-8-13(16)18/h3-9H,2,10H2,1H3
InChIKeyPWFDNKWSJQIMLW-UHFFFAOYSA-N
MW292.28 g/mol
LogP3.63
Rot. Bonds6

About 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone

2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone (PubChem CID 63269700) has the molecular formula C16H14F2O3 and a molecular weight of 292.28 g/mol. Its IUPAC name is 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone
PubChem CID63269700
Molecular FormulaC16H14F2O3
Molecular Weight292.28 g/mol
Exact Mass292.09
IUPAC Name2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone
SMILESCCOc1ccccc1C(=O)COc1cc(F)ccc1F
InChIInChI=1S/C16H14F2O3/c1-2-20-15-6-4-3-5-12(15)14(19)10-21-16-9-11(17)7-8-13(16)18/h3-9H,2,10H2,1H3
InChIKeyPWFDNKWSJQIMLW-UHFFFAOYSA-N
XLogP3.63
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.28
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-difluorophenoxy)-1-(2-fluorophenyl)ethanone
CID 63269522
2-(2,5-difluorophenoxy)-1-(2-methylphenyl)ethanone
CID 55169275
1-(2-ethoxyphenyl)-2-(2-fluoro-3-methylphenoxy)ethanone
CID 107659470
2-(3-bromo-5-fluorophenoxy)-1-(2-ethoxyphenyl)ethanone
CID 81315134
2-(2,5-difluorophenoxy)-1-(2,4-dimethylphenyl)ethanone
CID 63269744
1-(2-ethoxyphenyl)-2-(4-methylsulfanylphenoxy)ethanone
CID 63649372
ethane;1-(2-ethoxyphenyl)propan-1-one
CID 145111899
1-(2,5-difluorophenoxy)pentan-2-one
CID 63269916
2-(4-bromophenoxy)-1-(2-ethoxyphenyl)ethanone
CID 62029870
1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
CID 43799191
1-(2-ethoxyphenyl)-2-[4-(hydroxymethyl)phenoxy]ethanone
CID 61229921
2-(5-fluoro-2-nitrophenoxy)-1-(2-methoxyphenyl)ethanone
CID 8873297

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone?
The IUPAC name of 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone (CID 63269700) is 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone.
What is the SMILES notation for 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone?
The canonical SMILES for 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone is CCOc1ccccc1C(=O)COc1cc(F)ccc1F.
What is the InChIKey of 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone?
The InChIKey is PWFDNKWSJQIMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2O3/c1-2-20-15-6-4-3-5-12(15)14(19)10-21-16-9-11(17)7-8-13(16)18/h3-9H,2,10H2,1H3.
What are the key properties of 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone?
2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone has a molecular weight of 292.28 g/mol, XLogP of 3.63, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-difluorophenoxy)-1-(2-ethoxyphenyl)ethanone is sourced from PubChem (CID 63269700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).