3-Dimethylsilyloxy-6-ethyloctane

C12H27OSi — CID 6329295

IUPAC
SMILESCCC(CC)CCC(CC)O[Si](C)C
InChIInChI=1S/C12H27OSi/c1-6-11(7-2)9-10-12(8-3)13-14(4)5/h11-12H,6-10H2,1-5H3
InChIKeyXBNYDYGYVSRWSB-UHFFFAOYSA-N
MW215.43 g/mol
LogP4.25
Rot. Bonds8

About 3-Dimethylsilyloxy-6-ethyloctane

3-Dimethylsilyloxy-6-ethyloctane (PubChem CID 6329295) has the molecular formula C12H27OSi and a molecular weight of 215.43 g/mol.

Molecular Properties

Compound Name3-Dimethylsilyloxy-6-ethyloctane
PubChem CID6329295
Molecular FormulaC12H27OSi
Molecular Weight215.43 g/mol
Exact Mass215.18
IUPAC Name
SMILESCCC(CC)CCC(CC)O[Si](C)C
InChIInChI=1S/C12H27OSi/c1-6-11(7-2)9-10-12(8-3)13-14(4)5/h11-12H,6-10H2,1-5H3
InChIKeyXBNYDYGYVSRWSB-UHFFFAOYSA-N
XLogP4.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.43
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-Dimethylsilyloxy-6-ethyloctane?
The IUPAC name of 3-Dimethylsilyloxy-6-ethyloctane (CID 6329295) is not available.
What is the SMILES notation for 3-Dimethylsilyloxy-6-ethyloctane?
The canonical SMILES for 3-Dimethylsilyloxy-6-ethyloctane is CCC(CC)CCC(CC)O[Si](C)C.
What is the InChIKey of 3-Dimethylsilyloxy-6-ethyloctane?
The InChIKey is XBNYDYGYVSRWSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27OSi/c1-6-11(7-2)9-10-12(8-3)13-14(4)5/h11-12H,6-10H2,1-5H3.
What are the key properties of 3-Dimethylsilyloxy-6-ethyloctane?
3-Dimethylsilyloxy-6-ethyloctane has a molecular weight of 215.43 g/mol, XLogP of 4.25, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Dimethylsilyloxy-6-ethyloctane is sourced from PubChem (CID 6329295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).