(10,10-dioxophenoxathiin-1-yl)-trimethylsilane

C15H16O3SSi — CID 10590636

IUPAC(10,10-dioxophenoxathiin-1-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cccc2c1S(=O)(=O)c1ccccc1O2
InChIInChI=1S/C15H16O3SSi/c1-20(2,3)14-10-6-8-12-15(14)19(16,17)13-9-5-4-7-11(13)18-12/h4-10H,1-3H3
InChIKeyJZGWNXMLVVDMPN-UHFFFAOYSA-N
MW304.44 g/mol
LogP3.17
Rot. Bonds1

About (10,10-dioxophenoxathiin-1-yl)-trimethylsilane

(10,10-dioxophenoxathiin-1-yl)-trimethylsilane (PubChem CID 10590636) has the molecular formula C15H16O3SSi and a molecular weight of 304.44 g/mol. Its IUPAC name is (10,10-dioxophenoxathiin-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(10,10-dioxophenoxathiin-1-yl)-trimethylsilane
PubChem CID10590636
Molecular FormulaC15H16O3SSi
Molecular Weight304.44 g/mol
Exact Mass304.06
IUPAC Name(10,10-dioxophenoxathiin-1-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cccc2c1S(=O)(=O)c1ccccc1O2
InChIInChI=1S/C15H16O3SSi/c1-20(2,3)14-10-6-8-12-15(14)19(16,17)13-9-5-4-7-11(13)18-12/h4-10H,1-3H3
InChIKeyJZGWNXMLVVDMPN-UHFFFAOYSA-N
XLogP3.17
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 53.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (10,10-dioxophenoxathiin-1-yl)-trimethylsilane?
The IUPAC name of (10,10-dioxophenoxathiin-1-yl)-trimethylsilane (CID 10590636) is (10,10-dioxophenoxathiin-1-yl)-trimethylsilane.
What is the SMILES notation for (10,10-dioxophenoxathiin-1-yl)-trimethylsilane?
The canonical SMILES for (10,10-dioxophenoxathiin-1-yl)-trimethylsilane is C[Si](C)(C)c1cccc2c1S(=O)(=O)c1ccccc1O2.
What is the InChIKey of (10,10-dioxophenoxathiin-1-yl)-trimethylsilane?
The InChIKey is JZGWNXMLVVDMPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O3SSi/c1-20(2,3)14-10-6-8-12-15(14)19(16,17)13-9-5-4-7-11(13)18-12/h4-10H,1-3H3.
What are the key properties of (10,10-dioxophenoxathiin-1-yl)-trimethylsilane?
(10,10-dioxophenoxathiin-1-yl)-trimethylsilane has a molecular weight of 304.44 g/mol, XLogP of 3.17, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (10,10-dioxophenoxathiin-1-yl)-trimethylsilane is sourced from PubChem (CID 10590636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).