triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane

C21H38OSSi — CID 141041400

IUPACtriethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane
SMILESCC/C(=C\CCC(CC)(CC)O[Si](CC)(CC)CC)c1cccs1
InChIInChI=1S/C21H38OSSi/c1-7-19(20-16-14-18-23-20)15-13-17-21(8-2,9-3)22-24(10-4,11-5)12-6/h14-16,18H,7-13,17H2,1-6H3/b19-15+
InChIKeyHLKDUKWBLWHZHB-XDJHFCHBSA-N
MW366.69 g/mol
LogP7.90
Rot. Bonds12

About triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane

triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane (PubChem CID 141041400) has the molecular formula C21H38OSSi and a molecular weight of 366.69 g/mol. Its IUPAC name is triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane.

Molecular Properties

Compound Nametriethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane
PubChem CID141041400
Molecular FormulaC21H38OSSi
Molecular Weight366.69 g/mol
Exact Mass366.24
IUPAC Nametriethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane
SMILESCC/C(=C\CCC(CC)(CC)O[Si](CC)(CC)CC)c1cccs1
InChIInChI=1S/C21H38OSSi/c1-7-19(20-16-14-18-23-20)15-13-17-21(8-2,9-3)22-24(10-4,11-5)12-6/h14-16,18H,7-13,17H2,1-6H3/b19-15+
InChIKeyHLKDUKWBLWHZHB-XDJHFCHBSA-N
XLogP7.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.69
LogP ≤ 57.90
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

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CID 59972359
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CID 61333342
3-thiophen-2-ylpent-2-enenitrile
CID 76913769
2-[(E)-1-bromopent-2-en-2-yl]thiophene
CID 126676876
1-thiophen-2-ylpropan-1-one
CID 26179
2-[(Z)-1-chlorobut-1-enyl]thiophene
CID 102087090
ethoxycarbonyl thiophene-2-carboxylate
CID 174341165
2-[chloro(thiophen-2-yl)methylidene]butanal
CID 53423304
2-(3,3-dimethyl-1-thiophen-2-ylhex-1-enyl)thiophene
CID 146324274
2-[(E)-2-methyloct-3-en-4-yl]thiophene
CID 146324336
2-chloro-2-ethyl-1-thiophen-2-ylbutan-1-one
CID 45081139
(E)-4-thiophen-2-ylpent-3-en-1-amine
CID 82074766

Frequently Asked Questions

What is the IUPAC name of triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane?
The IUPAC name of triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane (CID 141041400) is triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane.
What is the SMILES notation for triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane?
The canonical SMILES for triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane is CC/C(=C\CCC(CC)(CC)O[Si](CC)(CC)CC)c1cccs1.
What is the InChIKey of triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane?
The InChIKey is HLKDUKWBLWHZHB-XDJHFCHBSA-N. The full InChI is InChI=1S/C21H38OSSi/c1-7-19(20-16-14-18-23-20)15-13-17-21(8-2,9-3)22-24(10-4,11-5)12-6/h14-16,18H,7-13,17H2,1-6H3/b19-15+.
What are the key properties of triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane?
triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane has a molecular weight of 366.69 g/mol, XLogP of 7.90, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(E)-3-ethyl-7-thiophen-2-ylnon-6-en-3-yl]oxysilane is sourced from PubChem (CID 141041400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).