2-trimethylsilyl-1-benzothiophen-7-ol

C11H14OSSi — CID 10704292

IUPAC2-trimethylsilyl-1-benzothiophen-7-ol
SMILESC[Si](C)(C)c1cc2cccc(O)c2s1
InChIInChI=1S/C11H14OSSi/c1-14(2,3)10-7-8-5-4-6-9(12)11(8)13-10/h4-7,12H,1-3H3
InChIKeyHGDYDIHYUCJQRP-UHFFFAOYSA-N
MW222.38 g/mol
LogP3.15
Rot. Bonds1

About 2-trimethylsilyl-1-benzothiophen-7-ol

2-trimethylsilyl-1-benzothiophen-7-ol (PubChem CID 10704292) has the molecular formula C11H14OSSi and a molecular weight of 222.38 g/mol. Its IUPAC name is 2-trimethylsilyl-1-benzothiophen-7-ol.

Molecular Properties

Compound Name2-trimethylsilyl-1-benzothiophen-7-ol
PubChem CID10704292
Molecular FormulaC11H14OSSi
Molecular Weight222.38 g/mol
Exact Mass222.05
IUPAC Name2-trimethylsilyl-1-benzothiophen-7-ol
SMILESC[Si](C)(C)c1cc2cccc(O)c2s1
InChIInChI=1S/C11H14OSSi/c1-14(2,3)10-7-8-5-4-6-9(12)11(8)13-10/h4-7,12H,1-3H3
InChIKeyHGDYDIHYUCJQRP-UHFFFAOYSA-N
XLogP3.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.15
H-Bond Donors ≤ 51
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 2-trimethylsilyl-1-benzothiophen-7-ol?
The IUPAC name of 2-trimethylsilyl-1-benzothiophen-7-ol (CID 10704292) is 2-trimethylsilyl-1-benzothiophen-7-ol.
What is the SMILES notation for 2-trimethylsilyl-1-benzothiophen-7-ol?
The canonical SMILES for 2-trimethylsilyl-1-benzothiophen-7-ol is C[Si](C)(C)c1cc2cccc(O)c2s1.
What is the InChIKey of 2-trimethylsilyl-1-benzothiophen-7-ol?
The InChIKey is HGDYDIHYUCJQRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14OSSi/c1-14(2,3)10-7-8-5-4-6-9(12)11(8)13-10/h4-7,12H,1-3H3.
What are the key properties of 2-trimethylsilyl-1-benzothiophen-7-ol?
2-trimethylsilyl-1-benzothiophen-7-ol has a molecular weight of 222.38 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilyl-1-benzothiophen-7-ol is sourced from PubChem (CID 10704292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).