(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane

C18H24O2S2Si2 — CID 102471459

IUPAC(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cccc2c1S(=O)c1cccc([Si](C)(C)C)c1S2=O
InChIInChI=1S/C18H24O2S2Si2/c1-23(2,3)15-11-7-9-13-17(15)21(19)14-10-8-12-16(24(4,5)6)18(14)22(13)20/h7-12H,1-6H3
InChIKeyWAVGRAAPLFZPIV-UHFFFAOYSA-N
MW392.69 g/mol
LogP3.42
Rot. Bonds2

About (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane

(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane (PubChem CID 102471459) has the molecular formula C18H24O2S2Si2 and a molecular weight of 392.69 g/mol. Its IUPAC name is (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane
PubChem CID102471459
Molecular FormulaC18H24O2S2Si2
Molecular Weight392.69 g/mol
Exact Mass392.08
IUPAC Name(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane
SMILESC[Si](C)(C)c1cccc2c1S(=O)c1cccc([Si](C)(C)C)c1S2=O
InChIInChI=1S/C18H24O2S2Si2/c1-23(2,3)15-11-7-9-13-17(15)21(19)14-10-8-12-16(24(4,5)6)18(14)22(13)20/h7-12H,1-6H3
InChIKeyWAVGRAAPLFZPIV-UHFFFAOYSA-N
XLogP3.42
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.69
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane?
The IUPAC name of (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane (CID 102471459) is (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane.
What is the SMILES notation for (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane?
The canonical SMILES for (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane is C[Si](C)(C)c1cccc2c1S(=O)c1cccc([Si](C)(C)C)c1S2=O.
What is the InChIKey of (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane?
The InChIKey is WAVGRAAPLFZPIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O2S2Si2/c1-23(2,3)15-11-7-9-13-17(15)21(19)14-10-8-12-16(24(4,5)6)18(14)22(13)20/h7-12H,1-6H3.
What are the key properties of (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane?
(5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane has a molecular weight of 392.69 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5,10-dioxo-6-trimethylsilylthianthren-1-yl)-trimethylsilane is sourced from PubChem (CID 102471459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).