[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate

C9H20O5Si2 — CID 154341695

IUPAC[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate
SMILESCC(=O)OC(OC(C)=O)[Si](C)(C)O[SiH](C)C
InChIInChI=1S/C9H20O5Si2/c1-7(10)12-9(13-8(2)11)16(5,6)14-15(3)4/h9,15H,1-6H3
InChIKeyLTTLTLFYKZLCNS-UHFFFAOYSA-N
MW264.43 g/mol
LogP1.18
Rot. Bonds5

About [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate

[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate (PubChem CID 154341695) has the molecular formula C9H20O5Si2 and a molecular weight of 264.43 g/mol. Its IUPAC name is [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate.

Molecular Properties

Compound Name[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate
PubChem CID154341695
Molecular FormulaC9H20O5Si2
Molecular Weight264.43 g/mol
Exact Mass264.08
IUPAC Name[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate
SMILESCC(=O)OC(OC(C)=O)[Si](C)(C)O[SiH](C)C
InChIInChI=1S/C9H20O5Si2/c1-7(10)12-9(13-8(2)11)16(5,6)14-15(3)4/h9,15H,1-6H3
InChIKeyLTTLTLFYKZLCNS-UHFFFAOYSA-N
XLogP1.18
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.43
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

propan-2-yl acetate;hydrochloride
CID 87336432
1-[dimethylsilyloxy(dimethyl)silyl]propan-1-one
CID 173203767
propane;propan-2-yl acetate
CID 23325886
(2-methyl-1-trimethylsilylprop-2-enyl) acetate
CID 11206237
1-[dimethoxy(methyl)silyl]ethyl acetate
CID 88687093
(2-acetyloxy-1,2-dichloroethyl) acetate
CID 536148
1-dichlorosilylethyl acetate
CID 173076621
[acetyloxy(trimethylsilyloxy)silyl] acetate
CID 123623987
1-trimethylsilylbutan-2-yl acetate
CID 20661380
(2R,3R)-2,3-diacetyloxybutanedioic acid
CID 2060943
N-methoxymethanamine;propan-2-yl acetate
CID 158428721
dimethylsilyloxy-[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilane;2-methylprop-2-enoic acid
CID 175053326

Frequently Asked Questions

What is the IUPAC name of [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate?
The IUPAC name of [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate (CID 154341695) is [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate.
What is the SMILES notation for [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate?
The canonical SMILES for [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate is CC(=O)OC(OC(C)=O)[Si](C)(C)O[SiH](C)C.
What is the InChIKey of [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate?
The InChIKey is LTTLTLFYKZLCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5Si2/c1-7(10)12-9(13-8(2)11)16(5,6)14-15(3)4/h9,15H,1-6H3.
What are the key properties of [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate?
[acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate has a molecular weight of 264.43 g/mol, XLogP of 1.18, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy-[dimethylsilyloxy(dimethyl)silyl]methyl] acetate is sourced from PubChem (CID 154341695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).