trimethyl-(2-methyl-1-benzothiophen-5-yl)silane

C12H16SSi — CID 170780872

IUPACtrimethyl-(2-methyl-1-benzothiophen-5-yl)silane
SMILESCc1cc2cc([Si](C)(C)C)ccc2s1
InChIInChI=1S/C12H16SSi/c1-9-7-10-8-11(14(2,3)4)5-6-12(10)13-9/h5-8H,1-4H3
InChIKeyKNITVRILVVCQMJ-UHFFFAOYSA-N
MW220.41 g/mol
LogP3.75
Rot. Bonds1

About trimethyl-(2-methyl-1-benzothiophen-5-yl)silane

trimethyl-(2-methyl-1-benzothiophen-5-yl)silane (PubChem CID 170780872) has the molecular formula C12H16SSi and a molecular weight of 220.41 g/mol. Its IUPAC name is trimethyl-(2-methyl-1-benzothiophen-5-yl)silane.

Molecular Properties

Compound Nametrimethyl-(2-methyl-1-benzothiophen-5-yl)silane
PubChem CID170780872
Molecular FormulaC12H16SSi
Molecular Weight220.41 g/mol
Exact Mass220.07
IUPAC Nametrimethyl-(2-methyl-1-benzothiophen-5-yl)silane
SMILESCc1cc2cc([Si](C)(C)C)ccc2s1
InChIInChI=1S/C12H16SSi/c1-9-7-10-8-11(14(2,3)4)5-6-12(10)13-9/h5-8H,1-4H3
InChIKeyKNITVRILVVCQMJ-UHFFFAOYSA-N
XLogP3.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.41
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-2-methyl-1-benzothiophene
CID 2747689
2-methyl-5-(trifluoromethyl)-1-benzothiophene
CID 58242584
(2,3-dimethyl-1-benzothiophen-5-yl)-trimethylsilane
CID 168837360
5-chloro-2-methyl-1-benzothiophene;ethane;propane
CID 142538359
ethane;2-methylthieno[3,2-c]pyridine
CID 144655773
trimethyl-(20-trimethylsilyl-7-hexacyclo[12.12.0.02,11.05,10.015,24.018,23]hexacosa-1(14),2(11),3,5(10),6,8,12,15(24),16,18(23),19,21,25-tridecaenyl)silane
CID 58411688
2-methyl-7H-thieno[3,2-f]indole
CID 69039188
5,6-difluoro-2-methyl-1-benzothiophene
CID 131029418
2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene
CID 59188490
2-methyl-2-(2-methyl-1-benzothiophen-5-yl)propanoic acid
CID 117204626
1-methyl-5-(2-methyl-1-benzothiophen-5-yl)-2H-tetrazol-1-ium
CID 150269415
2-methylbenzo[e][1]benzothiole
CID 13101461

Frequently Asked Questions

What is the IUPAC name of trimethyl-(2-methyl-1-benzothiophen-5-yl)silane?
The IUPAC name of trimethyl-(2-methyl-1-benzothiophen-5-yl)silane (CID 170780872) is trimethyl-(2-methyl-1-benzothiophen-5-yl)silane.
What is the SMILES notation for trimethyl-(2-methyl-1-benzothiophen-5-yl)silane?
The canonical SMILES for trimethyl-(2-methyl-1-benzothiophen-5-yl)silane is Cc1cc2cc([Si](C)(C)C)ccc2s1.
What is the InChIKey of trimethyl-(2-methyl-1-benzothiophen-5-yl)silane?
The InChIKey is KNITVRILVVCQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16SSi/c1-9-7-10-8-11(14(2,3)4)5-6-12(10)13-9/h5-8H,1-4H3.
What are the key properties of trimethyl-(2-methyl-1-benzothiophen-5-yl)silane?
trimethyl-(2-methyl-1-benzothiophen-5-yl)silane has a molecular weight of 220.41 g/mol, XLogP of 3.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-methyl-1-benzothiophen-5-yl)silane is sourced from PubChem (CID 170780872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).