dodec-1-enyl-ethenyl-dipropoxysilane

C20H40O2Si — CID 54307256

IUPACdodec-1-enyl-ethenyl-dipropoxysilane
SMILESC=C[Si](C=CCCCCCCCCCC)(OCCC)OCCC
InChIInChI=1S/C20H40O2Si/c1-5-9-10-11-12-13-14-15-16-17-20-23(8-4,21-18-6-2)22-19-7-3/h8,17,20H,4-7,9-16,18-19H2,1-3H3
InChIKeySIJVUHSAQWLQSX-UHFFFAOYSA-N
MW340.62 g/mol
LogP6.63
Rot. Bonds17

About dodec-1-enyl-ethenyl-dipropoxysilane

dodec-1-enyl-ethenyl-dipropoxysilane (PubChem CID 54307256) has the molecular formula C20H40O2Si and a molecular weight of 340.62 g/mol. Its IUPAC name is dodec-1-enyl-ethenyl-dipropoxysilane.

Molecular Properties

Compound Namedodec-1-enyl-ethenyl-dipropoxysilane
PubChem CID54307256
Molecular FormulaC20H40O2Si
Molecular Weight340.62 g/mol
Exact Mass340.28
IUPAC Namedodec-1-enyl-ethenyl-dipropoxysilane
SMILESC=C[Si](C=CCCCCCCCCCC)(OCCC)OCCC
InChIInChI=1S/C20H40O2Si/c1-5-9-10-11-12-13-14-15-16-17-20-23(8-4,21-18-6-2)22-19-7-3/h8,17,20H,4-7,9-16,18-19H2,1-3H3
InChIKeySIJVUHSAQWLQSX-UHFFFAOYSA-N
XLogP6.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.62
LogP ≤ 56.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 dodec-1-enyl-ethenyl-dipropoxysilane?
The IUPAC name of dodec-1-enyl-ethenyl-dipropoxysilane (CID 54307256) is dodec-1-enyl-ethenyl-dipropoxysilane.
What is the SMILES notation for dodec-1-enyl-ethenyl-dipropoxysilane?
The canonical SMILES for dodec-1-enyl-ethenyl-dipropoxysilane is C=C[Si](C=CCCCCCCCCCC)(OCCC)OCCC.
What is the InChIKey of dodec-1-enyl-ethenyl-dipropoxysilane?
The InChIKey is SIJVUHSAQWLQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O2Si/c1-5-9-10-11-12-13-14-15-16-17-20-23(8-4,21-18-6-2)22-19-7-3/h8,17,20H,4-7,9-16,18-19H2,1-3H3.
What are the key properties of dodec-1-enyl-ethenyl-dipropoxysilane?
dodec-1-enyl-ethenyl-dipropoxysilane has a molecular weight of 340.62 g/mol, XLogP of 6.63, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dodec-1-enyl-ethenyl-dipropoxysilane is sourced from PubChem (CID 54307256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).