dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane

C13H26OSSi2 — CID 177425091

IUPACdimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane
SMILESC[Si](C)(C)O[Si](C)(C)CCCCc1ccsc1
InChIInChI=1S/C13H26OSSi2/c1-16(2,3)14-17(4,5)11-7-6-8-13-9-10-15-12-13/h9-10,12H,6-8,11H2,1-5H3
InChIKeySSAXSICCJPJZOF-UHFFFAOYSA-N
MW286.59 g/mol
LogP5.13
Rot. Bonds7

About dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane

dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane (PubChem CID 177425091) has the molecular formula C13H26OSSi2 and a molecular weight of 286.59 g/mol. Its IUPAC name is dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane.

Molecular Properties

Compound Namedimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane
PubChem CID177425091
Molecular FormulaC13H26OSSi2
Molecular Weight286.59 g/mol
Exact Mass286.12
IUPAC Namedimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane
SMILESC[Si](C)(C)O[Si](C)(C)CCCCc1ccsc1
InChIInChI=1S/C13H26OSSi2/c1-16(2,3)14-17(4,5)11-7-6-8-13-9-10-15-12-13/h9-10,12H,6-8,11H2,1-5H3
InChIKeySSAXSICCJPJZOF-UHFFFAOYSA-N
XLogP5.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.59
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

butyl-dimethyl-(2-thiophen-3-ylethoxy)silane
CID 66964087
3-heptylthiophene;3-hexylthiophene
CID 159152668
4-thiophen-3-ylbutan-1-ol
CID 54222621
12-thiophen-3-yldodecan-1-ol
CID 67533520
3-(6-bromohexyl)thiophene
CID 11447992
12-thiophen-3-yldodecane-1-thiol
CID 71363861
3-(6,6-dimethylheptyl)thiophene
CID 174801737
azane;3-(6,6-dimethylheptyl)thiophene
CID 174801736
3-(5-bromohexyl)thiophene
CID 64506689
5-thiophen-3-ylpentanal
CID 15807672
3-heptylthiophene;oxaldehyde
CID 175169306
CID 23070262
CID 23070262

Frequently Asked Questions

What is the IUPAC name of dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane?
The IUPAC name of dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane (CID 177425091) is dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane.
What is the SMILES notation for dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane?
The canonical SMILES for dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane is C[Si](C)(C)O[Si](C)(C)CCCCc1ccsc1.
What is the InChIKey of dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane?
The InChIKey is SSAXSICCJPJZOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSSi2/c1-16(2,3)14-17(4,5)11-7-6-8-13-9-10-15-12-13/h9-10,12H,6-8,11H2,1-5H3.
What are the key properties of dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane?
dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane has a molecular weight of 286.59 g/mol, XLogP of 5.13, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(4-thiophen-3-ylbutyl)-trimethylsilyloxysilane is sourced from PubChem (CID 177425091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).