triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane

C14H26O3SSi — CID 139649676

IUPACtriethoxy-[3-(3-methylthiophen-2-yl)propyl]silane
SMILESCCO[Si](CCCc1sccc1C)(OCC)OCC
InChIInChI=1S/C14H26O3SSi/c1-5-15-19(16-6-2,17-7-3)12-8-9-14-13(4)10-11-18-14/h10-11H,5-9,12H2,1-4H3
InChIKeyKCOFOQXKCVMFBZ-UHFFFAOYSA-N
MW302.51 g/mol
LogP4.04
Rot. Bonds10

About triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane

triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane (PubChem CID 139649676) has the molecular formula C14H26O3SSi and a molecular weight of 302.51 g/mol. Its IUPAC name is triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3-(3-methylthiophen-2-yl)propyl]silane
PubChem CID139649676
Molecular FormulaC14H26O3SSi
Molecular Weight302.51 g/mol
Exact Mass302.14
IUPAC Nametriethoxy-[3-(3-methylthiophen-2-yl)propyl]silane
SMILESCCO[Si](CCCc1sccc1C)(OCC)OCC
InChIInChI=1S/C14H26O3SSi/c1-5-15-19(16-6-2,17-7-3)12-8-9-14-13(4)10-11-18-14/h10-11H,5-9,12H2,1-4H3
InChIKeyKCOFOQXKCVMFBZ-UHFFFAOYSA-N
XLogP4.04
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.51
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-hexyl-3-methylthiophene
CID 69043695
3-(3-methylthiophen-2-yl)propan-1-ol
CID 55267212
2-(3-methylthiophen-2-yl)ethanethiol
CID 55274895
2-[2-(3-methylthiophen-2-yl)ethoxy]ethanamine
CID 65305403
N'-methyl-N'-[2-(3-methylthiophen-2-yl)ethyl]butane-1,4-diamine
CID 115201578
triethoxy-[3-(2,4,6-trifluorophenyl)propyl]silane
CID 90170863
triethoxy(10-triethoxysilyldecyl)silane
CID 14439044
2,3-bis(3-triethoxysilylpropyl)aniline
CID 69038548
triethoxy-[3-(3-triethoxysilylpropoxy)propyl]silane
CID 22616805
N-(2-methoxyethyl)-5-(3-methylthiophen-2-yl)pentan-1-amine
CID 65305199
tripropoxy(3-thiophen-2-ylpropyl)silane
CID 141094365
methyl N-[2-(3-methylthiophen-2-yl)ethyl]carbamate
CID 115190738

Frequently Asked Questions

What is the IUPAC name of triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane?
The IUPAC name of triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane (CID 139649676) is triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane.
What is the SMILES notation for triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane?
The canonical SMILES for triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane is CCO[Si](CCCc1sccc1C)(OCC)OCC.
What is the InChIKey of triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane?
The InChIKey is KCOFOQXKCVMFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O3SSi/c1-5-15-19(16-6-2,17-7-3)12-8-9-14-13(4)10-11-18-14/h10-11H,5-9,12H2,1-4H3.
What are the key properties of triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane?
triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane has a molecular weight of 302.51 g/mol, XLogP of 4.04, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3-(3-methylthiophen-2-yl)propyl]silane is sourced from PubChem (CID 139649676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).