dibutoxy-(2-ethoxyethyl)-methylsilane

C13H30O3Si — CID 58512810

IUPACdibutoxy-(2-ethoxyethyl)-methylsilane
SMILESCCCCO[Si](C)(CCOCC)OCCCC
InChIInChI=1S/C13H30O3Si/c1-5-8-10-15-17(4,13-12-14-7-3)16-11-9-6-2/h5-13H2,1-4H3
InChIKeyKTBZTMRXDPCUIV-UHFFFAOYSA-N
MW262.47 g/mol
LogP3.73
Rot. Bonds12

About dibutoxy-(2-ethoxyethyl)-methylsilane

dibutoxy-(2-ethoxyethyl)-methylsilane (PubChem CID 58512810) has the molecular formula C13H30O3Si and a molecular weight of 262.47 g/mol. Its IUPAC name is dibutoxy-(2-ethoxyethyl)-methylsilane.

Molecular Properties

Compound Namedibutoxy-(2-ethoxyethyl)-methylsilane
PubChem CID58512810
Molecular FormulaC13H30O3Si
Molecular Weight262.47 g/mol
Exact Mass262.20
IUPAC Namedibutoxy-(2-ethoxyethyl)-methylsilane
SMILESCCCCO[Si](C)(CCOCC)OCCCC
InChIInChI=1S/C13H30O3Si/c1-5-8-10-15-17(4,13-12-14-7-3)16-11-9-6-2/h5-13H2,1-4H3
InChIKeyKTBZTMRXDPCUIV-UHFFFAOYSA-N
XLogP3.73
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.47
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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
dibutoxy-methyl-octylsilane
CID 54173263
ethane;1-ethoxybutane
CID 143206406
decyl-methyl-dipropoxysilane
CID 22228658
hexadecyl-methyl-dipropoxysilane
CID 22228671
ethane;1-ethoxybutane;molecular hydrogen
CID 143792167
diethoxy-methyl-undecylsilane
CID 140884401
1-(3-ethoxypropylperoxy)butane
CID 154387522
ethane-1,2-diol;1-ethoxybutane
CID 23504299
butoxy(tributyl)silane
CID 594608
butoxy-iodo-dimethylsilane
CID 88777497
3-[2-[diethoxy(methyl)silyl]ethoxy]-N,N-diethylpropan-1-amine
CID 90074831

Frequently Asked Questions

What is the IUPAC name of dibutoxy-(2-ethoxyethyl)-methylsilane?
The IUPAC name of dibutoxy-(2-ethoxyethyl)-methylsilane (CID 58512810) is dibutoxy-(2-ethoxyethyl)-methylsilane.
What is the SMILES notation for dibutoxy-(2-ethoxyethyl)-methylsilane?
The canonical SMILES for dibutoxy-(2-ethoxyethyl)-methylsilane is CCCCO[Si](C)(CCOCC)OCCCC.
What is the InChIKey of dibutoxy-(2-ethoxyethyl)-methylsilane?
The InChIKey is KTBZTMRXDPCUIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O3Si/c1-5-8-10-15-17(4,13-12-14-7-3)16-11-9-6-2/h5-13H2,1-4H3.
What are the key properties of dibutoxy-(2-ethoxyethyl)-methylsilane?
dibutoxy-(2-ethoxyethyl)-methylsilane has a molecular weight of 262.47 g/mol, XLogP of 3.73, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-(2-ethoxyethyl)-methylsilane is sourced from PubChem (CID 58512810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).