2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone

C16H15ClO3 — CID 65126569

IUPAC2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccccc1C(=O)COCc1cccc(Cl)c1
InChIInChI=1S/C16H15ClO3/c1-19-16-8-3-2-7-14(16)15(18)11-20-10-12-5-4-6-13(17)9-12/h2-9H,10-11H2,1H3
InChIKeyHLFGQWTUTWFXMJ-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.75
Rot. Bonds6

About 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone

2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone (PubChem CID 65126569) has the molecular formula C16H15ClO3 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone
PubChem CID65126569
Molecular FormulaC16H15ClO3
Molecular Weight290.75 g/mol
Exact Mass290.07
IUPAC Name2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone
SMILESCOc1ccccc1C(=O)COCc1cccc(Cl)c1
InChIInChI=1S/C16H15ClO3/c1-19-16-8-3-2-7-14(16)15(18)11-20-10-12-5-4-6-13(17)9-12/h2-9H,10-11H2,1H3
InChIKeyHLFGQWTUTWFXMJ-UHFFFAOYSA-N
XLogP3.75
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-chlorophenyl)methoxy]-1-(2,4-dimethylphenyl)ethanone
CID 65125946
1-(2-chlorophenyl)-2-[(3-methoxyphenyl)methoxy]ethanone
CID 62031532
2-[(3-chlorophenyl)methoxy]-1-(5-chlorothiophen-2-yl)ethanone
CID 65126522
2-[(3-bromophenyl)methoxy]-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 82809087
2-[(3-chlorophenyl)methoxy]-1-(furan-2-yl)ethanone
CID 65126472
2-[(3-bromophenyl)methoxy]-1-(2-ethoxyphenyl)ethanone
CID 82808702
1-(2,5-dichlorophenyl)-2-phenylmethoxyethanone
CID 62030960
methyl 5-chloro-2-(2-phenylmethoxyacetyl)benzoate
CID 146010495
1-(2,5-dichlorophenyl)-4-(2-methoxyphenyl)butane-1,4-dione
CID 90363445
1-(4,5-difluoro-2-methoxyphenyl)-2-phenylmethoxyethanone
CID 146006170
1-(2-chloro-3-methylphenyl)-2-phenylmethoxyethanone
CID 146009929
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665

Frequently Asked Questions

What is the IUPAC name of 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone?
The IUPAC name of 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone (CID 65126569) is 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone?
The canonical SMILES for 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone is COc1ccccc1C(=O)COCc1cccc(Cl)c1.
What is the InChIKey of 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone?
The InChIKey is HLFGQWTUTWFXMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClO3/c1-19-16-8-3-2-7-14(16)15(18)11-20-10-12-5-4-6-13(17)9-12/h2-9H,10-11H2,1H3.
What are the key properties of 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone?
2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone has a molecular weight of 290.75 g/mol, XLogP of 3.75, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chlorophenyl)methoxy]-1-(2-methoxyphenyl)ethanone is sourced from PubChem (CID 65126569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).