chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane

C12H22Cl2SSi2 — CID 139687650

IUPACchloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane
SMILESCC[Si](Cl)(CC)c1ccc([Si](Cl)(CC)CC)s1
InChIInChI=1S/C12H22Cl2SSi2/c1-5-16(13,6-2)11-9-10-12(15-11)17(14,7-3)8-4/h9-10H,5-8H2,1-4H3
InChIKeyKZVHAABXBRGGQW-UHFFFAOYSA-N
MW325.45 g/mol
LogP4.61
Rot. Bonds6

About chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane

chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane (PubChem CID 139687650) has the molecular formula C12H22Cl2SSi2 and a molecular weight of 325.45 g/mol. Its IUPAC name is chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane.

Molecular Properties

Compound Namechloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane
PubChem CID139687650
Molecular FormulaC12H22Cl2SSi2
Molecular Weight325.45 g/mol
Exact Mass324.04
IUPAC Namechloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane
SMILESCC[Si](Cl)(CC)c1ccc([Si](Cl)(CC)CC)s1
InChIInChI=1S/C12H22Cl2SSi2/c1-5-16(13,6-2)11-9-10-12(15-11)17(14,7-3)8-4/h9-10H,5-8H2,1-4H3
InChIKeyKZVHAABXBRGGQW-UHFFFAOYSA-N
XLogP4.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.45
LogP ≤ 54.61
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-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane?
The IUPAC name of chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane (CID 139687650) is chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane.
What is the SMILES notation for chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane?
The canonical SMILES for chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane is CC[Si](Cl)(CC)c1ccc([Si](Cl)(CC)CC)s1.
What is the InChIKey of chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane?
The InChIKey is KZVHAABXBRGGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22Cl2SSi2/c1-5-16(13,6-2)11-9-10-12(15-11)17(14,7-3)8-4/h9-10H,5-8H2,1-4H3.
What are the key properties of chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane?
chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane has a molecular weight of 325.45 g/mol, XLogP of 4.61, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[5-[chloro(diethyl)silyl]thiophen-2-yl]-diethylsilane is sourced from PubChem (CID 139687650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).