tripropoxy(tetradec-1-enyl)silane

C23H48O3Si — CID 155797355

IUPACtripropoxy(tetradec-1-enyl)silane
SMILESCCCCCCCCCCCCC=C[Si](OCCC)(OCCC)OCCC
InChIInChI=1S/C23H48O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-27(24-20-6-2,25-21-7-3)26-22-8-4/h19,23H,5-18,20-22H2,1-4H3
InChIKeyMZSRJHOBTJPCIJ-UHFFFAOYSA-N
MW400.72 g/mol
LogP7.61
Rot. Bonds21

About tripropoxy(tetradec-1-enyl)silane

tripropoxy(tetradec-1-enyl)silane (PubChem CID 155797355) has the molecular formula C23H48O3Si and a molecular weight of 400.72 g/mol. Its IUPAC name is tripropoxy(tetradec-1-enyl)silane.

Molecular Properties

Compound Nametripropoxy(tetradec-1-enyl)silane
PubChem CID155797355
Molecular FormulaC23H48O3Si
Molecular Weight400.72 g/mol
Exact Mass400.34
IUPAC Nametripropoxy(tetradec-1-enyl)silane
SMILESCCCCCCCCCCCCC=C[Si](OCCC)(OCCC)OCCC
InChIInChI=1S/C23H48O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-27(24-20-6-2,25-21-7-3)26-22-8-4/h19,23H,5-18,20-22H2,1-4H3
InChIKeyMZSRJHOBTJPCIJ-UHFFFAOYSA-N
XLogP7.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds21
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.72
LogP ≤ 57.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tripropoxy(tetradec-1-enyl)silane?
The IUPAC name of tripropoxy(tetradec-1-enyl)silane (CID 155797355) is tripropoxy(tetradec-1-enyl)silane.
What is the SMILES notation for tripropoxy(tetradec-1-enyl)silane?
The canonical SMILES for tripropoxy(tetradec-1-enyl)silane is CCCCCCCCCCCCC=C[Si](OCCC)(OCCC)OCCC.
What is the InChIKey of tripropoxy(tetradec-1-enyl)silane?
The InChIKey is MZSRJHOBTJPCIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48O3Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-23-27(24-20-6-2,25-21-7-3)26-22-8-4/h19,23H,5-18,20-22H2,1-4H3.
What are the key properties of tripropoxy(tetradec-1-enyl)silane?
tripropoxy(tetradec-1-enyl)silane has a molecular weight of 400.72 g/mol, XLogP of 7.61, 21 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tripropoxy(tetradec-1-enyl)silane is sourced from PubChem (CID 155797355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).