diethoxy-methyl-undecylsilane

C16H36O2Si — CID 140884401

IUPACdiethoxy-methyl-undecylsilane
SMILESCCCCCCCCCCC[Si](C)(OCC)OCC
InChIInChI=1S/C16H36O2Si/c1-5-8-9-10-11-12-13-14-15-16-19(4,17-6-2)18-7-3/h5-16H2,1-4H3
InChIKeyKCNWBALTKRMWCT-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.66
Rot. Bonds14

About diethoxy-methyl-undecylsilane

diethoxy-methyl-undecylsilane (PubChem CID 140884401) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is diethoxy-methyl-undecylsilane.

Molecular Properties

Compound Namediethoxy-methyl-undecylsilane
PubChem CID140884401
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namediethoxy-methyl-undecylsilane
SMILESCCCCCCCCCCC[Si](C)(OCC)OCC
InChIInChI=1S/C16H36O2Si/c1-5-8-9-10-11-12-13-14-15-16-19(4,17-6-2)18-7-3/h5-16H2,1-4H3
InChIKeyKCNWBALTKRMWCT-UHFFFAOYSA-N
XLogP5.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.66
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

ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
hexadecyl-methyl-dipropoxysilane
CID 22228671
decyl-methyl-dipropoxysilane
CID 22228658
dibutoxy-methyl-octylsilane
CID 54173263
ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane
CID 11110794
N-[3-[diethoxy(methyl)silyl]propyl]butan-1-amine
CID 22679052
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
dodecyl(triethoxy)silane;tridecane
CID 174970002
dibutoxy-[4-[dibutoxy(methyl)silyl]butyl]-methylsilane
CID 87144867
diethoxy-hexadecyl-tridecylsilane
CID 139614117
triethoxy(henicosyl)silane
CID 141362894

Frequently Asked Questions

What is the IUPAC name of diethoxy-methyl-undecylsilane?
The IUPAC name of diethoxy-methyl-undecylsilane (CID 140884401) is diethoxy-methyl-undecylsilane.
What is the SMILES notation for diethoxy-methyl-undecylsilane?
The canonical SMILES for diethoxy-methyl-undecylsilane is CCCCCCCCCCC[Si](C)(OCC)OCC.
What is the InChIKey of diethoxy-methyl-undecylsilane?
The InChIKey is KCNWBALTKRMWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-5-8-9-10-11-12-13-14-15-16-19(4,17-6-2)18-7-3/h5-16H2,1-4H3.
What are the key properties of diethoxy-methyl-undecylsilane?
diethoxy-methyl-undecylsilane has a molecular weight of 288.55 g/mol, XLogP of 5.66, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-undecylsilane is sourced from PubChem (CID 140884401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).