5-ethenyl-5-methylbenzo[b][1]benzosilole

C15H14Si — CID 91827973

IUPAC5-ethenyl-5-methylbenzo[b][1]benzosilole
SMILESC=C[Si]1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C15H14Si/c1-3-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)16/h3-11H,1H2,2H3
InChIKeyBLOQDNKXGZAAOF-UHFFFAOYSA-N
MW222.36 g/mol
LogP2.59
Rot. Bonds1

About 5-ethenyl-5-methylbenzo[b][1]benzosilole

5-ethenyl-5-methylbenzo[b][1]benzosilole (PubChem CID 91827973) has the molecular formula C15H14Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 5-ethenyl-5-methylbenzo[b][1]benzosilole.

Molecular Properties

Compound Name5-ethenyl-5-methylbenzo[b][1]benzosilole
PubChem CID91827973
Molecular FormulaC15H14Si
Molecular Weight222.36 g/mol
Exact Mass222.09
IUPAC Name5-ethenyl-5-methylbenzo[b][1]benzosilole
SMILESC=C[Si]1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C15H14Si/c1-3-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)16/h3-11H,1H2,2H3
InChIKeyBLOQDNKXGZAAOF-UHFFFAOYSA-N
XLogP2.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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-ethenyl-5-methylbenzo[b][1]benzosilole?
The IUPAC name of 5-ethenyl-5-methylbenzo[b][1]benzosilole (CID 91827973) is 5-ethenyl-5-methylbenzo[b][1]benzosilole.
What is the SMILES notation for 5-ethenyl-5-methylbenzo[b][1]benzosilole?
The canonical SMILES for 5-ethenyl-5-methylbenzo[b][1]benzosilole is C=C[Si]1(C)c2ccccc2-c2ccccc21.
What is the InChIKey of 5-ethenyl-5-methylbenzo[b][1]benzosilole?
The InChIKey is BLOQDNKXGZAAOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Si/c1-3-16(2)14-10-6-4-8-12(14)13-9-5-7-11-15(13)16/h3-11H,1H2,2H3.
What are the key properties of 5-ethenyl-5-methylbenzo[b][1]benzosilole?
5-ethenyl-5-methylbenzo[b][1]benzosilole has a molecular weight of 222.36 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-5-methylbenzo[b][1]benzosilole is sourced from PubChem (CID 91827973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).