[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate

C18H34O8Si2 — CID 154117413

IUPAC[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate
SMILESCC(=O)O[Si](C)(CCCCCCCC[Si](C)(OC(C)=O)OC(C)=O)OC(C)=O
InChIInChI=1S/C18H34O8Si2/c1-15(19)23-27(5,24-16(2)20)13-11-9-7-8-10-12-14-28(6,25-17(3)21)26-18(4)22/h7-14H2,1-6H3
InChIKeyZRSTZDZRWYOTRE-UHFFFAOYSA-N
MW434.63 g/mol
LogP3.72
Rot. Bonds13

About [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate

[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate (PubChem CID 154117413) has the molecular formula C18H34O8Si2 and a molecular weight of 434.63 g/mol. Its IUPAC name is [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate.

Molecular Properties

Compound Name[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate
PubChem CID154117413
Molecular FormulaC18H34O8Si2
Molecular Weight434.63 g/mol
Exact Mass434.18
IUPAC Name[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate
SMILESCC(=O)O[Si](C)(CCCCCCCC[Si](C)(OC(C)=O)OC(C)=O)OC(C)=O
InChIInChI=1S/C18H34O8Si2/c1-15(19)23-27(5,24-16(2)20)13-11-9-7-8-10-12-14-28(6,25-17(3)21)26-18(4)22/h7-14H2,1-6H3
InChIKeyZRSTZDZRWYOTRE-UHFFFAOYSA-N
XLogP3.72
TPSA105.20 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.63
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

[acetyloxy-(chloromethyl)-methylsilyl] acetate
CID 14272046
[acetyloxy-[3-(2-aminoethylamino)propyl]-methylsilyl] acetate
CID 87568873
[acetyloxy-(aminomethyl)-methylsilyl] acetate
CID 23065806
tridodecylsilyl acetate
CID 22926548
[acetyloxy-methyl-(2-phenylethyl)silyl] acetate
CID 54139822
[acetyloxy-(2-ethanethioyloxyethyl)-methylsilyl] acetate
CID 57169176
[acetyloxy-methyl-[3-(oxiran-2-ylmethoxy)propyl]silyl] acetate
CID 22292670
[butyl(dimethyl)silyl] acetate
CID 22926546
2-[diacetyloxy(methyl)silyl]ethyl prop-2-enoate
CID 154136555
[diacetyloxy(oct-7-enyl)silyl] acetate
CID 145259170
[3-methoxypropyl(dimethyl)silyl] acetate
CID 87592350
[acetyloxy-[[ethyl(methyl)amino]methyl]-methylsilyl] acetate
CID 90950928

Frequently Asked Questions

What is the IUPAC name of [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate?
The IUPAC name of [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate (CID 154117413) is [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate.
What is the SMILES notation for [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate?
The canonical SMILES for [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate is CC(=O)O[Si](C)(CCCCCCCC[Si](C)(OC(C)=O)OC(C)=O)OC(C)=O.
What is the InChIKey of [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate?
The InChIKey is ZRSTZDZRWYOTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34O8Si2/c1-15(19)23-27(5,24-16(2)20)13-11-9-7-8-10-12-14-28(6,25-17(3)21)26-18(4)22/h7-14H2,1-6H3.
What are the key properties of [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate?
[acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate has a molecular weight of 434.63 g/mol, XLogP of 3.72, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [acetyloxy-[8-[diacetyloxy(methyl)silyl]octyl]-methylsilyl] acetate is sourced from PubChem (CID 154117413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).