1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone

C18H20O4Si — CID 91742154

IUPAC1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone
SMILESCC(=O)c1ccc(O[Si](C)(C)Oc2ccc(C(C)=O)cc2)cc1
InChIInChI=1S/C18H20O4Si/c1-13(19)15-5-9-17(10-6-15)21-23(3,4)22-18-11-7-16(8-12-18)14(2)20/h5-12H,1-4H3
InChIKeyCJFYPSXJSDVYRL-UHFFFAOYSA-N
MW328.44 g/mol
LogP4.25
Rot. Bonds6

About 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone

1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone (PubChem CID 91742154) has the molecular formula C18H20O4Si and a molecular weight of 328.44 g/mol. Its IUPAC name is 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone.

Molecular Properties

Compound Name1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone
PubChem CID91742154
Molecular FormulaC18H20O4Si
Molecular Weight328.44 g/mol
Exact Mass328.11
IUPAC Name1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone
SMILESCC(=O)c1ccc(O[Si](C)(C)Oc2ccc(C(C)=O)cc2)cc1
InChIInChI=1S/C18H20O4Si/c1-13(19)15-5-9-17(10-6-15)21-23(3,4)22-18-11-7-16(8-12-18)14(2)20/h5-12H,1-4H3
InChIKeyCJFYPSXJSDVYRL-UHFFFAOYSA-N
XLogP4.25
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-sulfanyloxyphenyl)ethanone
CID 87171019
1-(4-methoxyphenyl)ethanone;hydrochloride
CID 23164565
1-(4-acetylphenyl)ethanone;methane
CID 159515104
4-(4-acetylphenoxy)benzoic acid
CID 60723234
1-acetyl-4-(sulfinoamino)oxybenzene
CID 165129203
1-[4-(iodomethoxy)phenyl]ethanone
CID 118233287
(4-acetylphenyl) carbamate;ethane
CID 163253714
1-(4-ethenoxyphenyl)ethanone
CID 14448263
[4-(4-acetylphenoxy)phenyl] acetate
CID 86194882
1-[4-tris(4-acetylphenyl)silylphenyl]ethanone
CID 149009059
1-[4-(1-chloroethoxy)phenyl]ethanone
CID 21282318
1-[4-[4-[4-[4-[4-(4-methylphenyl)phenoxy]phenoxy]phenyl]phenoxy]phenyl]ethanone
CID 126710300

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone?
The IUPAC name of 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone (CID 91742154) is 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone.
What is the SMILES notation for 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone?
The canonical SMILES for 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone is CC(=O)c1ccc(O[Si](C)(C)Oc2ccc(C(C)=O)cc2)cc1.
What is the InChIKey of 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone?
The InChIKey is CJFYPSXJSDVYRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O4Si/c1-13(19)15-5-9-17(10-6-15)21-23(3,4)22-18-11-7-16(8-12-18)14(2)20/h5-12H,1-4H3.
What are the key properties of 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone?
1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone has a molecular weight of 328.44 g/mol, XLogP of 4.25, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-acetylphenoxy)-dimethylsilyl]oxyphenyl]ethanone is sourced from PubChem (CID 91742154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).