2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone

C15H12F2O3 — CID 78908099

IUPAC2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone
SMILESCOc1ccc(C(=O)COc2c(F)cccc2F)cc1
InChIInChI=1S/C15H12F2O3/c1-19-11-7-5-10(6-8-11)14(18)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3
InChIKeyPFDLCONOVSYFSO-UHFFFAOYSA-N
MW278.25 g/mol
LogP3.24
Rot. Bonds5

About 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone

2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone (PubChem CID 78908099) has the molecular formula C15H12F2O3 and a molecular weight of 278.25 g/mol. Its IUPAC name is 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone
PubChem CID78908099
Molecular FormulaC15H12F2O3
Molecular Weight278.25 g/mol
Exact Mass278.08
IUPAC Name2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone
SMILESCOc1ccc(C(=O)COc2c(F)cccc2F)cc1
InChIInChI=1S/C15H12F2O3/c1-19-11-7-5-10(6-8-11)14(18)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3
InChIKeyPFDLCONOVSYFSO-UHFFFAOYSA-N
XLogP3.24
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.25
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-fluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 43413421
1-(3-bromo-4-methoxyphenyl)-2-(2,6-difluorophenoxy)ethanone
CID 78908137
1-(4-methoxyphenyl)-2-naphthalen-1-yloxyethanone
CID 896643
2-(2,6-difluorophenoxy)-1-(2-methoxyphenyl)ethanone
CID 78908110
2-(2-chloro-6-fluorophenoxy)-1-(3-chloro-4-methoxyphenyl)ethanone
CID 83052620
2-(2-chloro-6-fluorophenoxy)-1-phenylethanone
CID 83051091
[2-(4-methoxyphenyl)-2-oxoethyl] 1-(2-fluorophenyl)cyclopentane-1-carboxylate
CID 8661519
1-(4-chlorophenyl)-2-(3-methoxyphenoxy)ethanone
CID 43412672
2-(2-chloro-6-fluorophenoxy)-1-(4-propylphenyl)ethanone
CID 83052607
1-(3-fluoro-4-methoxyphenyl)-2-(3-methoxyphenoxy)ethanone
CID 43220187
2-methoxy-1-[4-(4-methoxyphenyl)phenyl]ethanone
CID 82053413
1-(2,6-difluorophenyl)-2-(3-methoxyphenoxy)ethanone
CID 43222244

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone?
The IUPAC name of 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone (CID 78908099) is 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone?
The canonical SMILES for 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone is COc1ccc(C(=O)COc2c(F)cccc2F)cc1.
What is the InChIKey of 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone?
The InChIKey is PFDLCONOVSYFSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2O3/c1-19-11-7-5-10(6-8-11)14(18)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3.
What are the key properties of 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone?
2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone has a molecular weight of 278.25 g/mol, XLogP of 3.24, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone is sourced from PubChem (CID 78908099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).