2-(2-chloro-6-fluorophenoxy)-1-phenylethanone

C14H10ClFO2 — CID 83051091

IUPAC2-(2-chloro-6-fluorophenoxy)-1-phenylethanone
SMILESO=C(COc1c(F)cccc1Cl)c1ccccc1
InChIInChI=1S/C14H10ClFO2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h1-8H,9H2
InChIKeyGWQDFCHEPLDHEU-UHFFFAOYSA-N
MW264.68 g/mol
LogP3.74
Rot. Bonds4

About 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone

2-(2-chloro-6-fluorophenoxy)-1-phenylethanone (PubChem CID 83051091) has the molecular formula C14H10ClFO2 and a molecular weight of 264.68 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenoxy)-1-phenylethanone
PubChem CID83051091
Molecular FormulaC14H10ClFO2
Molecular Weight264.68 g/mol
Exact Mass264.04
IUPAC Name2-(2-chloro-6-fluorophenoxy)-1-phenylethanone
SMILESO=C(COc1c(F)cccc1Cl)c1ccccc1
InChIInChI=1S/C14H10ClFO2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h1-8H,9H2
InChIKeyGWQDFCHEPLDHEU-UHFFFAOYSA-N
XLogP3.74
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.68
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-6-fluorophenoxy)-1-(4-propylphenyl)ethanone
CID 83052607
2-(2-chloro-6-fluorophenoxy)-1-(4-nitrophenyl)ethanone
CID 83052615
2-(2,6-dichlorophenoxy)-1-(2-fluorophenyl)ethanone
CID 60626540
2-(2-chloro-6-fluorophenoxy)-1-(3-chloro-4-methoxyphenyl)ethanone
CID 83052620
2-[(2-chloro-6-fluorophenoxy)methyl]prop-2-enoic acid
CID 83050552
2-(2,6-dibromophenoxy)-1-phenylethanone
CID 60593987
3-(2-chloro-6-fluorophenoxy)-1-(4-fluorophenyl)propan-1-one
CID 83050986
4-(2-chloro-6-fluorophenoxy)butanoic acid
CID 83051076
2-(2,6-difluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 78908099
1-[2-(2-chloro-6-fluorophenoxy)acetyl]piperidine-4-carboxylic acid
CID 83052469
2-(2,6-dichlorophenoxy)-1-(4-propylphenyl)ethanone
CID 60626549
2-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-1-phenylethanone
CID 134064664

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone?
The IUPAC name of 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone (CID 83051091) is 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone.
What is the SMILES notation for 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone?
The canonical SMILES for 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone is O=C(COc1c(F)cccc1Cl)c1ccccc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone?
The InChIKey is GWQDFCHEPLDHEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClFO2/c15-11-7-4-8-12(16)14(11)18-9-13(17)10-5-2-1-3-6-10/h1-8H,9H2.
What are the key properties of 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone?
2-(2-chloro-6-fluorophenoxy)-1-phenylethanone has a molecular weight of 264.68 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenoxy)-1-phenylethanone is sourced from PubChem (CID 83051091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).