dimethoxy-methyl-octadec-17-enylsilane

C21H44O2Si — CID 87930703

IUPACdimethoxy-methyl-octadec-17-enylsilane
SMILESC=CCCCCCCCCCCCCCCCC[Si](C)(OC)OC
InChIInChI=1S/C21H44O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(4,22-2)23-3/h5H,1,6-21H2,2-4H3
InChIKeyOUQFHSNOFIFQLS-UHFFFAOYSA-N
MW356.67 g/mol
LogP7.39
Rot. Bonds19

About dimethoxy-methyl-octadec-17-enylsilane

dimethoxy-methyl-octadec-17-enylsilane (PubChem CID 87930703) has the molecular formula C21H44O2Si and a molecular weight of 356.67 g/mol. Its IUPAC name is dimethoxy-methyl-octadec-17-enylsilane.

Molecular Properties

Compound Namedimethoxy-methyl-octadec-17-enylsilane
PubChem CID87930703
Molecular FormulaC21H44O2Si
Molecular Weight356.67 g/mol
Exact Mass356.31
IUPAC Namedimethoxy-methyl-octadec-17-enylsilane
SMILESC=CCCCCCCCCCCCCCCCC[Si](C)(OC)OC
InChIInChI=1S/C21H44O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(4,22-2)23-3/h5H,1,6-21H2,2-4H3
InChIKeyOUQFHSNOFIFQLS-UHFFFAOYSA-N
XLogP7.39
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.67
LogP ≤ 57.39
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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Related Compounds

5-[dimethoxy(methyl)silyl]pentyl-dimethoxy-methylsilane
CID 87101351
dichloro-methoxy-octadec-17-enylsilane
CID 18346316
docos-21-enyl-dihydroxy-methoxysilane
CID 123262992
bis(dodec-11-enyl)-dimethylsilane
CID 171781898
[bis(dodec-11-enyl)-methylsilyl]oxy-bis(dodec-11-enyl)-methylsilane
CID 177387156
fluoro-dimethyl-tridec-12-enylsilane
CID 58758055
dimethoxy-methyl-(3-prop-2-enoxypropyl)silane
CID 87181288
diethoxy-methoxy-oct-7-enylsilane
CID 87214506
ethoxy-hexadec-15-enyl-dimethoxysilane
CID 87214510
tetrakis[4-[dimethoxy(methyl)silyl]butyl]silane
CID 87832670
6-[dimethoxy(methyl)silyl]hexane-1-thiol
CID 158410124
7-[dimethoxy(methyl)silyl]heptane-1-thiol
CID 151105350

Frequently Asked Questions

What is the IUPAC name of dimethoxy-methyl-octadec-17-enylsilane?
The IUPAC name of dimethoxy-methyl-octadec-17-enylsilane (CID 87930703) is dimethoxy-methyl-octadec-17-enylsilane.
What is the SMILES notation for dimethoxy-methyl-octadec-17-enylsilane?
The canonical SMILES for dimethoxy-methyl-octadec-17-enylsilane is C=CCCCCCCCCCCCCCCCC[Si](C)(OC)OC.
What is the InChIKey of dimethoxy-methyl-octadec-17-enylsilane?
The InChIKey is OUQFHSNOFIFQLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(4,22-2)23-3/h5H,1,6-21H2,2-4H3.
What are the key properties of dimethoxy-methyl-octadec-17-enylsilane?
dimethoxy-methyl-octadec-17-enylsilane has a molecular weight of 356.67 g/mol, XLogP of 7.39, 19 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-methyl-octadec-17-enylsilane is sourced from PubChem (CID 87930703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).