dibutoxy-ethyl-(2-methylpropyl)silane

C14H32O2Si — CID 87899678

IUPACdibutoxy-ethyl-(2-methylpropyl)silane
SMILESCCCCO[Si](CC)(CC(C)C)OCCCC
InChIInChI=1S/C14H32O2Si/c1-6-9-11-15-17(8-3,13-14(4)5)16-12-10-7-2/h14H,6-13H2,1-5H3
InChIKeySJEUNWOQEOCEBW-UHFFFAOYSA-N
MW260.49 g/mol
LogP4.74
Rot. Bonds11

About dibutoxy-ethyl-(2-methylpropyl)silane

dibutoxy-ethyl-(2-methylpropyl)silane (PubChem CID 87899678) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is dibutoxy-ethyl-(2-methylpropyl)silane.

Molecular Properties

Compound Namedibutoxy-ethyl-(2-methylpropyl)silane
PubChem CID87899678
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Namedibutoxy-ethyl-(2-methylpropyl)silane
SMILESCCCCO[Si](CC)(CC(C)C)OCCCC
InChIInChI=1S/C14H32O2Si/c1-6-9-11-15-17(8-3,13-14(4)5)16-12-10-7-2/h14H,6-13H2,1-5H3
InChIKeySJEUNWOQEOCEBW-UHFFFAOYSA-N
XLogP4.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.49
LogP ≤ 54.74
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 dibutoxy-ethyl-(2-methylpropyl)silane?
The IUPAC name of dibutoxy-ethyl-(2-methylpropyl)silane (CID 87899678) is dibutoxy-ethyl-(2-methylpropyl)silane.
What is the SMILES notation for dibutoxy-ethyl-(2-methylpropyl)silane?
The canonical SMILES for dibutoxy-ethyl-(2-methylpropyl)silane is CCCCO[Si](CC)(CC(C)C)OCCCC.
What is the InChIKey of dibutoxy-ethyl-(2-methylpropyl)silane?
The InChIKey is SJEUNWOQEOCEBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-6-9-11-15-17(8-3,13-14(4)5)16-12-10-7-2/h14H,6-13H2,1-5H3.
What are the key properties of dibutoxy-ethyl-(2-methylpropyl)silane?
dibutoxy-ethyl-(2-methylpropyl)silane has a molecular weight of 260.49 g/mol, XLogP of 4.74, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-ethyl-(2-methylpropyl)silane is sourced from PubChem (CID 87899678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).