(2-silyloxysilylethanethioyl) acetate

C4H10O3SSi2 — CID 173483104

IUPAC(2-silyloxysilylethanethioyl) acetate
SMILESCC(=O)OC(=S)C[SiH2]O[SiH3]
InChIInChI=1S/C4H10O3SSi2/c1-3(5)6-4(8)2-10-7-9/h2,10H2,1,9H3
InChIKeyPWJFVZBJZFLXIE-UHFFFAOYSA-N
MW194.36 g/mol
LogP-1.32
Rot. Bonds3

About (2-silyloxysilylethanethioyl) acetate

(2-silyloxysilylethanethioyl) acetate (PubChem CID 173483104) has the molecular formula C4H10O3SSi2 and a molecular weight of 194.36 g/mol. Its IUPAC name is (2-silyloxysilylethanethioyl) acetate.

Molecular Properties

Compound Name(2-silyloxysilylethanethioyl) acetate
PubChem CID173483104
Molecular FormulaC4H10O3SSi2
Molecular Weight194.36 g/mol
Exact Mass193.99
IUPAC Name(2-silyloxysilylethanethioyl) acetate
SMILESCC(=O)OC(=S)C[SiH2]O[SiH3]
InChIInChI=1S/C4H10O3SSi2/c1-3(5)6-4(8)2-10-7-9/h2,10H2,1,9H3
InChIKeyPWJFVZBJZFLXIE-UHFFFAOYSA-N
XLogP-1.32
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.36
LogP ≤ 5-1.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

acetyl acetate;hydrochloride
CID 87138027
acetyl acetate;chromium(2+)
CID 19978523
CID 160689228
CID 160689228
[2-(2,5-dioxopyrrolidin-1-yl)ethanethioyl] acetate
CID 87965610
acetyl 2-aminoacetate
CID 13153876
acetyl acetate;carbanide;gold
CID 87857087
acetyl acetate;zinc;dihydrate
CID 174593639
aluminum;acetyl acetate;trichloride
CID 86584360
dicalcium;acetyl acetate;hydride
CID 174404063
ethoxycarbonyl acetate
CID 169432619
acetyl acetate;1,2-dichloroethane
CID 161071038
1-silyloxysilylethanone
CID 154037854

Frequently Asked Questions

What is the IUPAC name of (2-silyloxysilylethanethioyl) acetate?
The IUPAC name of (2-silyloxysilylethanethioyl) acetate (CID 173483104) is (2-silyloxysilylethanethioyl) acetate.
What is the SMILES notation for (2-silyloxysilylethanethioyl) acetate?
The canonical SMILES for (2-silyloxysilylethanethioyl) acetate is CC(=O)OC(=S)C[SiH2]O[SiH3].
What is the InChIKey of (2-silyloxysilylethanethioyl) acetate?
The InChIKey is PWJFVZBJZFLXIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3SSi2/c1-3(5)6-4(8)2-10-7-9/h2,10H2,1,9H3.
What are the key properties of (2-silyloxysilylethanethioyl) acetate?
(2-silyloxysilylethanethioyl) acetate has a molecular weight of 194.36 g/mol, XLogP of -1.32, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-silyloxysilylethanethioyl) acetate is sourced from PubChem (CID 173483104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).