1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone

C17H24OSi2 — CID 101185973

IUPAC1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone
SMILESCC(=O)c1ccc([Si](C)(C)[Si](C)(C)C)c2ccccc12
InChIInChI=1S/C17H24OSi2/c1-13(18)14-11-12-17(20(5,6)19(2,3)4)16-10-8-7-9-15(14)16/h7-12H,1-6H3
InChIKeyPQHYFGLRODMQEY-UHFFFAOYSA-N
MW300.55 g/mol
LogP4.37
Rot. Bonds3

About 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone

1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone (PubChem CID 101185973) has the molecular formula C17H24OSi2 and a molecular weight of 300.55 g/mol. Its IUPAC name is 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone
PubChem CID101185973
Molecular FormulaC17H24OSi2
Molecular Weight300.55 g/mol
Exact Mass300.14
IUPAC Name1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone
SMILESCC(=O)c1ccc([Si](C)(C)[Si](C)(C)C)c2ccccc12
InChIInChI=1S/C17H24OSi2/c1-13(18)14-11-12-17(20(5,6)19(2,3)4)16-10-8-7-9-15(14)16/h7-12H,1-6H3
InChIKeyPQHYFGLRODMQEY-UHFFFAOYSA-N
XLogP4.37
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.55
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(4-trimethylsilyloxynaphthalen-1-yl)ethanone
CID 167726517
1-[2-[[(2-acetylphenyl)-dimethylsilyl]-dimethylsilyl]phenyl]ethanone
CID 101417764
1-(4-hydroxynaphthalen-1-yl)ethanone;methoxymethane
CID 174734462
4-acetylnaphthalene-1-carbaldehyde
CID 59092057
4-acetyl-N-phenylnaphthalene-1-carboxamide
CID 70204412
1-[4-(4-acetylnaphthalen-1-yl)phenyl]ethanone
CID 58315812
1-(5-methylnaphthalen-1-yl)ethanone
CID 15563480
1-(1-chloroisoquinolin-4-yl)ethanone
CID 53402377
1-(2-acetylphenyl)ethanone;methane
CID 158210616
1-(4-hexylnaphthalen-1-yl)ethanone
CID 125472643
1-(10-acetylanthracen-9-yl)ethanone
CID 12739255
1-(3,4-diaminonaphthalen-1-yl)ethanone
CID 154200913

Frequently Asked Questions

What is the IUPAC name of 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone?
The IUPAC name of 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone (CID 101185973) is 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone.
What is the SMILES notation for 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone?
The canonical SMILES for 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone is CC(=O)c1ccc([Si](C)(C)[Si](C)(C)C)c2ccccc12.
What is the InChIKey of 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone?
The InChIKey is PQHYFGLRODMQEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24OSi2/c1-13(18)14-11-12-17(20(5,6)19(2,3)4)16-10-8-7-9-15(14)16/h7-12H,1-6H3.
What are the key properties of 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone?
1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone has a molecular weight of 300.55 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[dimethyl(trimethylsilyl)silyl]naphthalen-1-yl]ethanone is sourced from PubChem (CID 101185973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).