O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate

C7H16O2SSi — CID 86585691

IUPACO-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate
SMILESCO[Si](C)(C)CCOC(C)=S
InChIInChI=1S/C7H16O2SSi/c1-7(10)9-5-6-11(3,4)8-2/h5-6H2,1-4H3
InChIKeyXNSYTOZFTIEDHZ-UHFFFAOYSA-N
MW192.36 g/mol
LogP2.20
Rot. Bonds4

About O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate

O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate (PubChem CID 86585691) has the molecular formula C7H16O2SSi and a molecular weight of 192.36 g/mol. Its IUPAC name is O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate.

Molecular Properties

Compound NameO-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate
PubChem CID86585691
Molecular FormulaC7H16O2SSi
Molecular Weight192.36 g/mol
Exact Mass192.06
IUPAC NameO-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate
SMILESCO[Si](C)(C)CCOC(C)=S
InChIInChI=1S/C7H16O2SSi/c1-7(10)9-5-6-11(3,4)8-2/h5-6H2,1-4H3
InChIKeyXNSYTOZFTIEDHZ-UHFFFAOYSA-N
XLogP2.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.36
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

O-[2-[diethoxy(methyl)silyl]ethyl] ethanethioate
CID 57259196
[acetyloxy-(2-ethanethioyloxyethyl)-methylsilyl] acetate
CID 57169176
1-[2-[methoxy(dimethyl)silyl]ethoxy]propan-2-ol
CID 161271830
dimethoxy-methyl-(2-prop-1-en-2-yloxyethyl)silane
CID 87181274
3-[methoxy(dimethyl)silyl]propan-1-amine
CID 2733753
2-[2-[methoxy(dimethyl)silyl]ethyl-dimethylsilyl]ethanamine
CID 140737413
dimethoxy-[2-[methoxy(dimethyl)silyl]ethyl]-methylsilane
CID 59514896
11-[methoxy(dimethyl)silyl]undecyl 2-methylprop-2-enoate
CID 142567351
10-[methoxy(dimethyl)silyl]decyl 2-methylprop-2-enoate
CID 142567352
2-[methoxy(dimethyl)silyl]ethylurea
CID 87336564
N-[3-[methoxy(dimethyl)silyl]propyl]propan-2-imine
CID 87583755
3-[dimethoxy(methyl)silyl]propyl 2-methylprop-2-enoate;3-[methoxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 87862843

Frequently Asked Questions

What is the IUPAC name of O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate?
The IUPAC name of O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate (CID 86585691) is O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate.
What is the SMILES notation for O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate?
The canonical SMILES for O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate is CO[Si](C)(C)CCOC(C)=S.
What is the InChIKey of O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate?
The InChIKey is XNSYTOZFTIEDHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2SSi/c1-7(10)9-5-6-11(3,4)8-2/h5-6H2,1-4H3.
What are the key properties of O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate?
O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate has a molecular weight of 192.36 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-[methoxy(dimethyl)silyl]ethyl] ethanethioate is sourced from PubChem (CID 86585691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).