2-(4-phenacyloxyphenoxy)-1-phenylethanone

C22H18O4 — CID 962120

IUPAC2-(4-phenacyloxyphenoxy)-1-phenylethanone
SMILESO=C(COc1ccc(OCC(=O)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C22H18O4/c23-21(17-7-3-1-4-8-17)15-25-19-11-13-20(14-12-19)26-16-22(24)18-9-5-2-6-10-18/h1-14H,15-16H2
InChIKeyFNPIZYZBLSYMQM-UHFFFAOYSA-N
MW346.38 g/mol
LogP4.21
Rot. Bonds8

About 2-(4-phenacyloxyphenoxy)-1-phenylethanone

2-(4-phenacyloxyphenoxy)-1-phenylethanone (PubChem CID 962120) has the molecular formula C22H18O4 and a molecular weight of 346.38 g/mol. Its IUPAC name is 2-(4-phenacyloxyphenoxy)-1-phenylethanone.

Molecular Properties

Compound Name2-(4-phenacyloxyphenoxy)-1-phenylethanone
PubChem CID962120
Molecular FormulaC22H18O4
Molecular Weight346.38 g/mol
Exact Mass346.12
IUPAC Name2-(4-phenacyloxyphenoxy)-1-phenylethanone
SMILESO=C(COc1ccc(OCC(=O)c2ccccc2)cc1)c1ccccc1
InChIInChI=1S/C22H18O4/c23-21(17-7-3-1-4-8-17)15-25-19-11-13-20(14-12-19)26-16-22(24)18-9-5-2-6-10-18/h1-14H,15-16H2
InChIKeyFNPIZYZBLSYMQM-UHFFFAOYSA-N
XLogP4.21
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.38
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

phenol;2-phenoxy-1-phenylethanone
CID 161484281
CID 123801738
CID 123801738
1-phenyl-2-[4-(trifluoromethyl)phenoxy]ethanone
CID 60624077
1-(4-phenacyloxyphenyl)-3-phenylurea
CID 172640057
1-(4-bromophenyl)-2-(4-phenylphenoxy)ethanone
CID 4309178
2-[4-[4-(3,3-dichloroprop-2-enoxy)phenoxy]phenoxy]-1-phenylethanone
CID 139900449
2-phenacyloxy-1-phenylethanone
CID 12781821
2-(3-butoxyphenoxy)-1-phenylethanone
CID 15692245
2-(4-chloro-3-methylphenoxy)-1-phenylethanone
CID 54035942
3-[4-[(4-phenacyloxyphenyl)methoxy]phenyl]propanamide
CID 66685338
1-(3,5-dichlorophenyl)-2-phenoxyethanone
CID 146005989
[2-(4-chlorophenyl)-2-oxoethyl] 2-(4-benzoylphenoxy)acetate
CID 8925584

Frequently Asked Questions

What is the IUPAC name of 2-(4-phenacyloxyphenoxy)-1-phenylethanone?
The IUPAC name of 2-(4-phenacyloxyphenoxy)-1-phenylethanone (CID 962120) is 2-(4-phenacyloxyphenoxy)-1-phenylethanone.
What is the SMILES notation for 2-(4-phenacyloxyphenoxy)-1-phenylethanone?
The canonical SMILES for 2-(4-phenacyloxyphenoxy)-1-phenylethanone is O=C(COc1ccc(OCC(=O)c2ccccc2)cc1)c1ccccc1.
What is the InChIKey of 2-(4-phenacyloxyphenoxy)-1-phenylethanone?
The InChIKey is FNPIZYZBLSYMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18O4/c23-21(17-7-3-1-4-8-17)15-25-19-11-13-20(14-12-19)26-16-22(24)18-9-5-2-6-10-18/h1-14H,15-16H2.
What are the key properties of 2-(4-phenacyloxyphenoxy)-1-phenylethanone?
2-(4-phenacyloxyphenoxy)-1-phenylethanone has a molecular weight of 346.38 g/mol, XLogP of 4.21, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenacyloxyphenoxy)-1-phenylethanone is sourced from PubChem (CID 962120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).