hexadecyl-methoxy-methyl-trimethylsilyloxysilane

C21H48O2Si2 — CID 121233874

IUPAChexadecyl-methoxy-methyl-trimethylsilyloxysilane
SMILESCCCCCCCCCCCCCCCC[Si](C)(OC)O[Si](C)(C)C
InChIInChI=1S/C21H48O2Si2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(6,22-2)23-24(3,4)5/h7-21H2,1-6H3
InChIKeyCMUDPAKFOFFESL-UHFFFAOYSA-N
MW388.79 g/mol
LogP8.04
Rot. Bonds18

About hexadecyl-methoxy-methyl-trimethylsilyloxysilane

hexadecyl-methoxy-methyl-trimethylsilyloxysilane (PubChem CID 121233874) has the molecular formula C21H48O2Si2 and a molecular weight of 388.79 g/mol. Its IUPAC name is hexadecyl-methoxy-methyl-trimethylsilyloxysilane.

Molecular Properties

Compound Namehexadecyl-methoxy-methyl-trimethylsilyloxysilane
PubChem CID121233874
Molecular FormulaC21H48O2Si2
Molecular Weight388.79 g/mol
Exact Mass388.32
IUPAC Namehexadecyl-methoxy-methyl-trimethylsilyloxysilane
SMILESCCCCCCCCCCCCCCCC[Si](C)(OC)O[Si](C)(C)C
InChIInChI=1S/C21H48O2Si2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(6,22-2)23-24(3,4)5/h7-21H2,1-6H3
InChIKeyCMUDPAKFOFFESL-UHFFFAOYSA-N
XLogP8.04
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds18
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.79
LogP ≤ 58.04
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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Frequently Asked Questions

What is the IUPAC name of hexadecyl-methoxy-methyl-trimethylsilyloxysilane?
The IUPAC name of hexadecyl-methoxy-methyl-trimethylsilyloxysilane (CID 121233874) is hexadecyl-methoxy-methyl-trimethylsilyloxysilane.
What is the SMILES notation for hexadecyl-methoxy-methyl-trimethylsilyloxysilane?
The canonical SMILES for hexadecyl-methoxy-methyl-trimethylsilyloxysilane is CCCCCCCCCCCCCCCC[Si](C)(OC)O[Si](C)(C)C.
What is the InChIKey of hexadecyl-methoxy-methyl-trimethylsilyloxysilane?
The InChIKey is CMUDPAKFOFFESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H48O2Si2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(6,22-2)23-24(3,4)5/h7-21H2,1-6H3.
What are the key properties of hexadecyl-methoxy-methyl-trimethylsilyloxysilane?
hexadecyl-methoxy-methyl-trimethylsilyloxysilane has a molecular weight of 388.79 g/mol, XLogP of 8.04, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexadecyl-methoxy-methyl-trimethylsilyloxysilane is sourced from PubChem (CID 121233874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).