diethyl(dithiophen-2-yl)silane

C12H16S2Si — CID 121007146

IUPACdiethyl(dithiophen-2-yl)silane
SMILESCC[Si](CC)(c1cccs1)c1cccs1
InChIInChI=1S/C12H16S2Si/c1-3-15(4-2,11-7-5-9-13-11)12-8-6-10-14-12/h5-10H,3-4H2,1-2H3
InChIKeyKKSQUBNSXFAKES-UHFFFAOYSA-N
MW252.48 g/mol
LogP3.41
Rot. Bonds4

About diethyl(dithiophen-2-yl)silane

diethyl(dithiophen-2-yl)silane (PubChem CID 121007146) has the molecular formula C12H16S2Si and a molecular weight of 252.48 g/mol. Its IUPAC name is diethyl(dithiophen-2-yl)silane.

Molecular Properties

Compound Namediethyl(dithiophen-2-yl)silane
PubChem CID121007146
Molecular FormulaC12H16S2Si
Molecular Weight252.48 g/mol
Exact Mass252.05
IUPAC Namediethyl(dithiophen-2-yl)silane
SMILESCC[Si](CC)(c1cccs1)c1cccs1
InChIInChI=1S/C12H16S2Si/c1-3-15(4-2,11-7-5-9-13-11)12-8-6-10-14-12/h5-10H,3-4H2,1-2H3
InChIKeyKKSQUBNSXFAKES-UHFFFAOYSA-N
XLogP3.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.48
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl-di(propan-2-yloxy)-thiophen-2-ylsilane
CID 142755646
dipropoxy(dithiophen-2-yl)silane
CID 139618620
difluoro-methyl-thiophen-2-ylsilane
CID 139680773
ethoxy-dimethoxy-thiophen-2-ylsilane
CID 174992196
CID 136744211
CID 136744211
dimethoxy-methyl-thiophen-2-ylsilane
CID 13397349
dichloro-(3-iodopropyl)-thiophen-2-ylsilane
CID 119088499
methoxy-(2-methylpropyl)-propan-2-yl-thiophen-2-ylsilane
CID 140844251
ethane;thiophen-2-amine
CID 19844309
4-[2-[dimethyl(thiophen-2-yl)silyl]ethyl]-2,6-diethylphenol
CID 57123733
chloromethyl-methyl-(4-phenylphenyl)-thiophen-2-ylsilane
CID 57292962
but-1-yne;2-thiophen-2-ylthiophene
CID 174755152

Frequently Asked Questions

What is the IUPAC name of diethyl(dithiophen-2-yl)silane?
The IUPAC name of diethyl(dithiophen-2-yl)silane (CID 121007146) is diethyl(dithiophen-2-yl)silane.
What is the SMILES notation for diethyl(dithiophen-2-yl)silane?
The canonical SMILES for diethyl(dithiophen-2-yl)silane is CC[Si](CC)(c1cccs1)c1cccs1.
What is the InChIKey of diethyl(dithiophen-2-yl)silane?
The InChIKey is KKSQUBNSXFAKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16S2Si/c1-3-15(4-2,11-7-5-9-13-11)12-8-6-10-14-12/h5-10H,3-4H2,1-2H3.
What are the key properties of diethyl(dithiophen-2-yl)silane?
diethyl(dithiophen-2-yl)silane has a molecular weight of 252.48 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl(dithiophen-2-yl)silane is sourced from PubChem (CID 121007146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).