2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone

C16H16O4 — CID 761236

IUPAC2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone
SMILESCOc1ccc(C(=O)COc2ccccc2OC)cc1
InChIInChI=1S/C16H16O4/c1-18-13-9-7-12(8-10-13)14(17)11-20-16-6-4-3-5-15(16)19-2/h3-10H,11H2,1-2H3
InChIKeyXZENRLBGEKSCQB-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.97
Rot. Bonds6

About 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone

2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone (PubChem CID 761236) has the molecular formula C16H16O4 and a molecular weight of 272.30 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone
PubChem CID761236
Molecular FormulaC16H16O4
Molecular Weight272.30 g/mol
Exact Mass272.10
IUPAC Name2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone
SMILESCOc1ccc(C(=O)COc2ccccc2OC)cc1
InChIInChI=1S/C16H16O4/c1-18-13-9-7-12(8-10-13)14(17)11-20-16-6-4-3-5-15(16)19-2/h3-10H,11H2,1-2H3
InChIKeyXZENRLBGEKSCQB-UHFFFAOYSA-N
XLogP2.97
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone?
The IUPAC name of 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone (CID 761236) is 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone.
What is the SMILES notation for 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone?
The canonical SMILES for 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone is COc1ccc(C(=O)COc2ccccc2OC)cc1.
What is the InChIKey of 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone?
The InChIKey is XZENRLBGEKSCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O4/c1-18-13-9-7-12(8-10-13)14(17)11-20-16-6-4-3-5-15(16)19-2/h3-10H,11H2,1-2H3.
What are the key properties of 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone?
2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone has a molecular weight of 272.30 g/mol, XLogP of 2.97, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-1-(4-methoxyphenyl)ethanone is sourced from PubChem (CID 761236), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).