trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane

C19H40O2Si — CID 89415176

IUPACtrimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane
SMILESCCCCCCCCCCC=C(OC(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H40O2Si/c1-8-9-10-11-12-13-14-15-16-17-18(20-19(2,3)4)21-22(5,6)7/h17H,8-16H2,1-7H3
InChIKeyIOXVFJIZJWEKEO-UHFFFAOYSA-N
MW328.61 g/mol
LogP7.03
Rot. Bonds12

About trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane

trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane (PubChem CID 89415176) has the molecular formula C19H40O2Si and a molecular weight of 328.61 g/mol. Its IUPAC name is trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane.

Molecular Properties

Compound Nametrimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane
PubChem CID89415176
Molecular FormulaC19H40O2Si
Molecular Weight328.61 g/mol
Exact Mass328.28
IUPAC Nametrimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane
SMILESCCCCCCCCCCC=C(OC(C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H40O2Si/c1-8-9-10-11-12-13-14-15-16-17-18(20-19(2,3)4)21-22(5,6)7/h17H,8-16H2,1-7H3
InChIKeyIOXVFJIZJWEKEO-UHFFFAOYSA-N
XLogP7.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.61
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane?
The IUPAC name of trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane (CID 89415176) is trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane.
What is the SMILES notation for trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane?
The canonical SMILES for trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane is CCCCCCCCCCC=C(OC(C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane?
The InChIKey is IOXVFJIZJWEKEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O2Si/c1-8-9-10-11-12-13-14-15-16-17-18(20-19(2,3)4)21-22(5,6)7/h17H,8-16H2,1-7H3.
What are the key properties of trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane?
trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane has a molecular weight of 328.61 g/mol, XLogP of 7.03, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1-[(2-methylpropan-2-yl)oxy]dodec-1-enoxy]silane is sourced from PubChem (CID 89415176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).