triethyl-(3-methyl-1-benzothiophen-2-yl)silane

C15H22SSi — CID 154716564

IUPACtriethyl-(3-methyl-1-benzothiophen-2-yl)silane
SMILESCC[Si](CC)(CC)c1sc2ccccc2c1C
InChIInChI=1S/C15H22SSi/c1-5-17(6-2,7-3)15-12(4)13-10-8-9-11-14(13)16-15/h8-11H,5-7H2,1-4H3
InChIKeyPLDNVHDZHPAIAV-UHFFFAOYSA-N
MW262.49 g/mol
LogP4.93
Rot. Bonds4

About triethyl-(3-methyl-1-benzothiophen-2-yl)silane

triethyl-(3-methyl-1-benzothiophen-2-yl)silane (PubChem CID 154716564) has the molecular formula C15H22SSi and a molecular weight of 262.49 g/mol. Its IUPAC name is triethyl-(3-methyl-1-benzothiophen-2-yl)silane.

Molecular Properties

Compound Nametriethyl-(3-methyl-1-benzothiophen-2-yl)silane
PubChem CID154716564
Molecular FormulaC15H22SSi
Molecular Weight262.49 g/mol
Exact Mass262.12
IUPAC Nametriethyl-(3-methyl-1-benzothiophen-2-yl)silane
SMILESCC[Si](CC)(CC)c1sc2ccccc2c1C
InChIInChI=1S/C15H22SSi/c1-5-17(6-2,7-3)15-12(4)13-10-8-9-11-14(13)16-15/h8-11H,5-7H2,1-4H3
InChIKeyPLDNVHDZHPAIAV-UHFFFAOYSA-N
XLogP4.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.49
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 triethyl-(3-methyl-1-benzothiophen-2-yl)silane?
The IUPAC name of triethyl-(3-methyl-1-benzothiophen-2-yl)silane (CID 154716564) is triethyl-(3-methyl-1-benzothiophen-2-yl)silane.
What is the SMILES notation for triethyl-(3-methyl-1-benzothiophen-2-yl)silane?
The canonical SMILES for triethyl-(3-methyl-1-benzothiophen-2-yl)silane is CC[Si](CC)(CC)c1sc2ccccc2c1C.
What is the InChIKey of triethyl-(3-methyl-1-benzothiophen-2-yl)silane?
The InChIKey is PLDNVHDZHPAIAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22SSi/c1-5-17(6-2,7-3)15-12(4)13-10-8-9-11-14(13)16-15/h8-11H,5-7H2,1-4H3.
What are the key properties of triethyl-(3-methyl-1-benzothiophen-2-yl)silane?
triethyl-(3-methyl-1-benzothiophen-2-yl)silane has a molecular weight of 262.49 g/mol, XLogP of 4.93, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(3-methyl-1-benzothiophen-2-yl)silane is sourced from PubChem (CID 154716564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).