butoxy-dodecoxy-ethenyl-methylsilane

C19H40O2Si — CID 91742140

IUPACbutoxy-dodecoxy-ethenyl-methylsilane
SMILESC=C[Si](C)(OCCCC)OCCCCCCCCCCCC
InChIInChI=1S/C19H40O2Si/c1-5-8-10-11-12-13-14-15-16-17-19-21-22(4,7-3)20-18-9-6-2/h7H,3,5-6,8-19H2,1-2,4H3
InChIKeySCHCIDNRHCSFRY-UHFFFAOYSA-N
MW328.61 g/mol
LogP6.54
Rot. Bonds17

About butoxy-dodecoxy-ethenyl-methylsilane

butoxy-dodecoxy-ethenyl-methylsilane (PubChem CID 91742140) has the molecular formula C19H40O2Si and a molecular weight of 328.61 g/mol. Its IUPAC name is butoxy-dodecoxy-ethenyl-methylsilane.

Molecular Properties

Compound Namebutoxy-dodecoxy-ethenyl-methylsilane
PubChem CID91742140
Molecular FormulaC19H40O2Si
Molecular Weight328.61 g/mol
Exact Mass328.28
IUPAC Namebutoxy-dodecoxy-ethenyl-methylsilane
SMILESC=C[Si](C)(OCCCC)OCCCCCCCCCCCC
InChIInChI=1S/C19H40O2Si/c1-5-8-10-11-12-13-14-15-16-17-19-21-22(4,7-3)20-18-9-6-2/h7H,3,5-6,8-19H2,1-2,4H3
InChIKeySCHCIDNRHCSFRY-UHFFFAOYSA-N
XLogP6.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.61
LogP ≤ 56.54
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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Related Compounds

dodecoxy-ethenyl-methyl-undecoxysilane
CID 91744966
ethenyl-heptoxy-hexadecoxy-methylsilane
CID 91744965
dodecoxy-ethenyl-methyl-pentadecoxysilane
CID 91745623
ethenyl-heptoxy-methyl-tridecoxysilane
CID 91744074
decoxy-ethenyl-methyl-nonoxysilane
CID 91743696
ethenyl-heptoxy-methyl-tetradecoxysilane
CID 91744411
ethenyl-methyl-dipentoxysilane
CID 71381989
ethenyl-ethoxy-hexoxy-methylsilane
CID 91733084
ethenyl-heptadecoxy-methyl-(2-methylpropoxy)silane
CID 91744408
2,4-dimethylpentan-3-yloxy-ethenyl-heptoxy-methylsilane
CID 91739060
2,4-dimethylpentan-3-yloxy-(dodecoxy-ethenyl-methylsilyl)oxy-ethenyl-methylsilane
CID 91743254
2,4-dimethylpentan-3-yloxy-ethenyl-(ethenyl-methyl-nonoxysilyl)oxy-methylsilane
CID 91741576

Frequently Asked Questions

What is the IUPAC name of butoxy-dodecoxy-ethenyl-methylsilane?
The IUPAC name of butoxy-dodecoxy-ethenyl-methylsilane (CID 91742140) is butoxy-dodecoxy-ethenyl-methylsilane.
What is the SMILES notation for butoxy-dodecoxy-ethenyl-methylsilane?
The canonical SMILES for butoxy-dodecoxy-ethenyl-methylsilane is C=C[Si](C)(OCCCC)OCCCCCCCCCCCC.
What is the InChIKey of butoxy-dodecoxy-ethenyl-methylsilane?
The InChIKey is SCHCIDNRHCSFRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O2Si/c1-5-8-10-11-12-13-14-15-16-17-19-21-22(4,7-3)20-18-9-6-2/h7H,3,5-6,8-19H2,1-2,4H3.
What are the key properties of butoxy-dodecoxy-ethenyl-methylsilane?
butoxy-dodecoxy-ethenyl-methylsilane has a molecular weight of 328.61 g/mol, XLogP of 6.54, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dodecoxy-ethenyl-methylsilane is sourced from PubChem (CID 91742140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).