dibutoxy-methyl-octylsilane

C17H38O2Si — CID 54173263

IUPACdibutoxy-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(OCCCC)OCCCC
InChIInChI=1S/C17H38O2Si/c1-5-8-11-12-13-14-17-20(4,18-15-9-6-2)19-16-10-7-3/h5-17H2,1-4H3
InChIKeyOWMPYFFBQVDGDA-UHFFFAOYSA-N
MW302.57 g/mol
LogP6.05
Rot. Bonds15

About dibutoxy-methyl-octylsilane

dibutoxy-methyl-octylsilane (PubChem CID 54173263) has the molecular formula C17H38O2Si and a molecular weight of 302.57 g/mol. Its IUPAC name is dibutoxy-methyl-octylsilane.

Molecular Properties

Compound Namedibutoxy-methyl-octylsilane
PubChem CID54173263
Molecular FormulaC17H38O2Si
Molecular Weight302.57 g/mol
Exact Mass302.26
IUPAC Namedibutoxy-methyl-octylsilane
SMILESCCCCCCCC[Si](C)(OCCCC)OCCCC
InChIInChI=1S/C17H38O2Si/c1-5-8-11-12-13-14-17-20(4,18-15-9-6-2)19-16-10-7-3/h5-17H2,1-4H3
InChIKeyOWMPYFFBQVDGDA-UHFFFAOYSA-N
XLogP6.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.57
LogP ≤ 56.05
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

dibutoxy-[4-[dibutoxy(methyl)silyl]butyl]-methylsilane
CID 87144867
decyl-methyl-dipropoxysilane
CID 22228658
hexadecyl-methyl-dipropoxysilane
CID 22228671
diethoxy-methyl-undecylsilane
CID 140884401
dibutoxy-(2-ethoxyethyl)-methylsilane
CID 58512810
hexadecoxy-dimethyl-octylsilane
CID 627002
dodecoxy-dimethyl-octylsilane
CID 618139
11-[dihexoxy(methyl)silyl]undecyl 2-methylprop-2-enoate
CID 142567348
hexadecyl-methyl-bis(trimethylsilyloxy)silane
CID 71356149
butoxy-ethoxy-dioctylsilane
CID 89350080
hexoxy-dimethyl-nonoxysilane
CID 91741085
triheptoxy(methyl)silane
CID 525768

Frequently Asked Questions

What is the IUPAC name of dibutoxy-methyl-octylsilane?
The IUPAC name of dibutoxy-methyl-octylsilane (CID 54173263) is dibutoxy-methyl-octylsilane.
What is the SMILES notation for dibutoxy-methyl-octylsilane?
The canonical SMILES for dibutoxy-methyl-octylsilane is CCCCCCCC[Si](C)(OCCCC)OCCCC.
What is the InChIKey of dibutoxy-methyl-octylsilane?
The InChIKey is OWMPYFFBQVDGDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38O2Si/c1-5-8-11-12-13-14-17-20(4,18-15-9-6-2)19-16-10-7-3/h5-17H2,1-4H3.
What are the key properties of dibutoxy-methyl-octylsilane?
dibutoxy-methyl-octylsilane has a molecular weight of 302.57 g/mol, XLogP of 6.05, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-methyl-octylsilane is sourced from PubChem (CID 54173263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).