1-[2-(2,4-dimethylphenoxy)phenyl]ethanone

C16H16O2 — CID 14797515

IUPAC1-[2-(2,4-dimethylphenoxy)phenyl]ethanone
SMILESCC(=O)c1ccccc1Oc1ccc(C)cc1C
InChIInChI=1S/C16H16O2/c1-11-8-9-15(12(2)10-11)18-16-7-5-4-6-14(16)13(3)17/h4-10H,1-3H3
InChIKeyUIAXKJRPJDEVAF-UHFFFAOYSA-N
MW240.30 g/mol
LogP4.30
Rot. Bonds3

About 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone

1-[2-(2,4-dimethylphenoxy)phenyl]ethanone (PubChem CID 14797515) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone.

Molecular Properties

Compound Name1-[2-(2,4-dimethylphenoxy)phenyl]ethanone
PubChem CID14797515
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name1-[2-(2,4-dimethylphenoxy)phenyl]ethanone
SMILESCC(=O)c1ccccc1Oc1ccc(C)cc1C
InChIInChI=1S/C16H16O2/c1-11-8-9-15(12(2)10-11)18-16-7-5-4-6-14(16)13(3)17/h4-10H,1-3H3
InChIKeyUIAXKJRPJDEVAF-UHFFFAOYSA-N
XLogP4.30
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-dimethylphenoxy)phenol
CID 91665530
1-[5-(2,4-dimethylphenoxy)-2-methylphenyl]ethanone
CID 59067571
1-[2-(5-bromo-2-methylphenoxy)phenyl]ethanone
CID 107284751
2-(2-hydroxy-5-methylphenoxy)benzoic acid
CID 14221471
1-[2-(4-chloro-3,5-dimethylphenoxy)phenyl]ethanone
CID 43369973
1-[2-[2-(2,4-dimethylphenyl)sulfanylethoxy]phenyl]ethanone
CID 43413802
1-[2-[4-(2-methoxy-4-methylphenoxy)butoxy]phenyl]ethanone
CID 2899242
1-[2-(4-bromo-2-chlorophenoxy)phenyl]ethanone
CID 28880169
3-(2,4-dimethylphenoxy)-2-ethylperoxybenzoic acid
CID 88652542
1-[2-(4-bromo-2-methylphenoxy)-5-fluorophenyl]ethanone
CID 63532818
2-(2-methyl-4-propan-2-ylphenoxy)benzoic acid
CID 175986634
formaldehyde;bis(1-(2-methoxyphenyl)ethanone)
CID 174959963

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone?
The IUPAC name of 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone (CID 14797515) is 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone.
What is the SMILES notation for 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone?
The canonical SMILES for 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone is CC(=O)c1ccccc1Oc1ccc(C)cc1C.
What is the InChIKey of 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone?
The InChIKey is UIAXKJRPJDEVAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-11-8-9-15(12(2)10-11)18-16-7-5-4-6-14(16)13(3)17/h4-10H,1-3H3.
What are the key properties of 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone?
1-[2-(2,4-dimethylphenoxy)phenyl]ethanone has a molecular weight of 240.30 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,4-dimethylphenoxy)phenyl]ethanone is sourced from PubChem (CID 14797515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).