[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane

C23H48O2Si — CID 91739057

IUPAC[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane
SMILESCCCCCCCCC/C=C/CO[Si](C)(C)OCCCCCCCCC
InChIInChI=1S/C23H48O2Si/c1-5-7-9-11-13-14-15-17-19-21-23-25-26(3,4)24-22-20-18-16-12-10-8-6-2/h19,21H,5-18,20,22-23H2,1-4H3/b21-19+
InChIKeyFKDGQTZCKQSITD-XUTLUUPISA-N
MW384.72 g/mol
LogP8.17
Rot. Bonds20

About [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane

[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane (PubChem CID 91739057) has the molecular formula C23H48O2Si and a molecular weight of 384.72 g/mol. Its IUPAC name is [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane.

Molecular Properties

Compound Name[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane
PubChem CID91739057
Molecular FormulaC23H48O2Si
Molecular Weight384.72 g/mol
Exact Mass384.34
IUPAC Name[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane
SMILESCCCCCCCCC/C=C/CO[Si](C)(C)OCCCCCCCCC
InChIInChI=1S/C23H48O2Si/c1-5-7-9-11-13-14-15-17-19-21-23-25-26(3,4)24-22-20-18-16-12-10-8-6-2/h19,21H,5-18,20,22-23H2,1-4H3/b21-19+
InChIKeyFKDGQTZCKQSITD-XUTLUUPISA-N
XLogP8.17
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.72
LogP ≤ 58.17
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane?
The IUPAC name of [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane (CID 91739057) is [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane.
What is the SMILES notation for [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane?
The canonical SMILES for [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane is CCCCCCCCC/C=C/CO[Si](C)(C)OCCCCCCCCC.
What is the InChIKey of [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane?
The InChIKey is FKDGQTZCKQSITD-XUTLUUPISA-N. The full InChI is InChI=1S/C23H48O2Si/c1-5-7-9-11-13-14-15-17-19-21-23-25-26(3,4)24-22-20-18-16-12-10-8-6-2/h19,21H,5-18,20,22-23H2,1-4H3/b21-19+.
What are the key properties of [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane?
[(E)-dodec-2-enoxy]-dimethyl-nonoxysilane has a molecular weight of 384.72 g/mol, XLogP of 8.17, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-dodec-2-enoxy]-dimethyl-nonoxysilane is sourced from PubChem (CID 91739057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).