chloro-dimethyl-thiophen-3-ylsilane

C6H9ClSSi — CID 67742947

IUPACchloro-dimethyl-thiophen-3-ylsilane
SMILESC[Si](C)(Cl)c1ccsc1
InChIInChI=1S/C6H9ClSSi/c1-9(2,7)6-3-4-8-5-6/h3-5H,1-2H3
InChIKeyTZMFQNADFMIXQK-UHFFFAOYSA-N
MW176.74 g/mol
LogP2.40
Rot. Bonds1

About chloro-dimethyl-thiophen-3-ylsilane

chloro-dimethyl-thiophen-3-ylsilane (PubChem CID 67742947) has the molecular formula C6H9ClSSi and a molecular weight of 176.74 g/mol. Its IUPAC name is chloro-dimethyl-thiophen-3-ylsilane.

Molecular Properties

Compound Namechloro-dimethyl-thiophen-3-ylsilane
PubChem CID67742947
Molecular FormulaC6H9ClSSi
Molecular Weight176.74 g/mol
Exact Mass175.99
IUPAC Namechloro-dimethyl-thiophen-3-ylsilane
SMILESC[Si](C)(Cl)c1ccsc1
InChIInChI=1S/C6H9ClSSi/c1-9(2,7)6-3-4-8-5-6/h3-5H,1-2H3
InChIKeyTZMFQNADFMIXQK-UHFFFAOYSA-N
XLogP2.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.74
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-dimethyl-thiophen-3-ylsilane?
The IUPAC name of chloro-dimethyl-thiophen-3-ylsilane (CID 67742947) is chloro-dimethyl-thiophen-3-ylsilane.
What is the SMILES notation for chloro-dimethyl-thiophen-3-ylsilane?
The canonical SMILES for chloro-dimethyl-thiophen-3-ylsilane is C[Si](C)(Cl)c1ccsc1.
What is the InChIKey of chloro-dimethyl-thiophen-3-ylsilane?
The InChIKey is TZMFQNADFMIXQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9ClSSi/c1-9(2,7)6-3-4-8-5-6/h3-5H,1-2H3.
What are the key properties of chloro-dimethyl-thiophen-3-ylsilane?
chloro-dimethyl-thiophen-3-ylsilane has a molecular weight of 176.74 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-thiophen-3-ylsilane is sourced from PubChem (CID 67742947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).