trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane

C12H18OSSi — CID 146003769

IUPACtrimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane
SMILESCC(C)(C#Cc1cccs1)O[Si](C)(C)C
InChIInChI=1S/C12H18OSSi/c1-12(2,13-15(3,4)5)9-8-11-7-6-10-14-11/h6-7,10H,1-5H3
InChIKeyDYOKYAIGKCGPKD-UHFFFAOYSA-N
MW238.43 g/mol
LogP3.73
Rot. Bonds2

About trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane

trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane (PubChem CID 146003769) has the molecular formula C12H18OSSi and a molecular weight of 238.43 g/mol. Its IUPAC name is trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane.

Molecular Properties

Compound Nametrimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane
PubChem CID146003769
Molecular FormulaC12H18OSSi
Molecular Weight238.43 g/mol
Exact Mass238.08
IUPAC Nametrimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane
SMILESCC(C)(C#Cc1cccs1)O[Si](C)(C)C
InChIInChI=1S/C12H18OSSi/c1-12(2,13-15(3,4)5)9-8-11-7-6-10-14-11/h6-7,10H,1-5H3
InChIKeyDYOKYAIGKCGPKD-UHFFFAOYSA-N
XLogP3.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.43
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-4-thiophen-2-ylbut-3-yne-1,2-diol
CID 44519880
2-phenyl-4-thiophen-2-ylbut-3-yn-2-ol
CID 130055842
(2S)-2-thiophen-2-yl-2-trimethylsilyloxypropanenitrile
CID 11557646
2-prop-1-ynyl-5-(2-thiophen-2-ylethynyl)thiophene
CID 642329
4,4-dimethyl-1-thiophen-2-yl-3-(1,2,4-triazol-1-ylmethyl)pent-1-yn-3-ol
CID 14328504
N-tert-butyl-4-thiophen-2-ylbut-3-yn-1-amine
CID 58124810
2-[2-(4-methoxyphenyl)ethynyl]thiophene
CID 46218240
2-[2-[methyl(2-thiophen-2-ylethynyl)phosphoryl]ethynyl]thiophene
CID 164687205
bicyclo[3.1.0]hexa-1(6),2,4-triene;2-prop-1-ynylthiophene
CID 175010018
2,5-bis(2-thiophen-2-ylethynyl)-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 59270675
ethyl 4-thiophen-2-ylbut-3-ynoate
CID 170470618
ethane;thiophene-2-carbonitrile
CID 143604797

Frequently Asked Questions

What is the IUPAC name of trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane?
The IUPAC name of trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane (CID 146003769) is trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane.
What is the SMILES notation for trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane?
The canonical SMILES for trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane is CC(C)(C#Cc1cccs1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane?
The InChIKey is DYOKYAIGKCGPKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18OSSi/c1-12(2,13-15(3,4)5)9-8-11-7-6-10-14-11/h6-7,10H,1-5H3.
What are the key properties of trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane?
trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane has a molecular weight of 238.43 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-methyl-4-thiophen-2-ylbut-3-yn-2-yl)oxysilane is sourced from PubChem (CID 146003769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).