butoxy-diethyl-heptan-2-yloxysilane

C15H34O2Si — CID 91738233

IUPACbutoxy-diethyl-heptan-2-yloxysilane
SMILESCCCCCC(C)O[Si](CC)(CC)OCCCC
InChIInChI=1S/C15H34O2Si/c1-6-10-12-13-15(5)17-18(8-3,9-4)16-14-11-7-2/h15H,6-14H2,1-5H3
InChIKeyWKINZKPBKVHQMF-UHFFFAOYSA-N
MW274.52 g/mol
LogP5.27
Rot. Bonds12

About butoxy-diethyl-heptan-2-yloxysilane

butoxy-diethyl-heptan-2-yloxysilane (PubChem CID 91738233) has the molecular formula C15H34O2Si and a molecular weight of 274.52 g/mol. Its IUPAC name is butoxy-diethyl-heptan-2-yloxysilane.

Molecular Properties

Compound Namebutoxy-diethyl-heptan-2-yloxysilane
PubChem CID91738233
Molecular FormulaC15H34O2Si
Molecular Weight274.52 g/mol
Exact Mass274.23
IUPAC Namebutoxy-diethyl-heptan-2-yloxysilane
SMILESCCCCCC(C)O[Si](CC)(CC)OCCCC
InChIInChI=1S/C15H34O2Si/c1-6-10-12-13-15(5)17-18(8-3,9-4)16-14-11-7-2/h15H,6-14H2,1-5H3
InChIKeyWKINZKPBKVHQMF-UHFFFAOYSA-N
XLogP5.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 55.27
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 butoxy-diethyl-heptan-2-yloxysilane?
The IUPAC name of butoxy-diethyl-heptan-2-yloxysilane (CID 91738233) is butoxy-diethyl-heptan-2-yloxysilane.
What is the SMILES notation for butoxy-diethyl-heptan-2-yloxysilane?
The canonical SMILES for butoxy-diethyl-heptan-2-yloxysilane is CCCCCC(C)O[Si](CC)(CC)OCCCC.
What is the InChIKey of butoxy-diethyl-heptan-2-yloxysilane?
The InChIKey is WKINZKPBKVHQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O2Si/c1-6-10-12-13-15(5)17-18(8-3,9-4)16-14-11-7-2/h15H,6-14H2,1-5H3.
What are the key properties of butoxy-diethyl-heptan-2-yloxysilane?
butoxy-diethyl-heptan-2-yloxysilane has a molecular weight of 274.52 g/mol, XLogP of 5.27, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-diethyl-heptan-2-yloxysilane is sourced from PubChem (CID 91738233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).