3,5-dimethylheptan-3-yloxy(trimethyl)silane

C12H28OSi — CID 91189399

IUPAC3,5-dimethylheptan-3-yloxy(trimethyl)silane
SMILESCCC(C)CC(C)(CC)O[Si](C)(C)C
InChIInChI=1S/C12H28OSi/c1-8-11(3)10-12(4,9-2)13-14(5,6)7/h11H,8-10H2,1-7H3
InChIKeyXSPMABRQYGERDO-UHFFFAOYSA-N
MW216.44 g/mol
LogP4.44
Rot. Bonds6

About 3,5-dimethylheptan-3-yloxy(trimethyl)silane

3,5-dimethylheptan-3-yloxy(trimethyl)silane (PubChem CID 91189399) has the molecular formula C12H28OSi and a molecular weight of 216.44 g/mol. Its IUPAC name is 3,5-dimethylheptan-3-yloxy(trimethyl)silane.

Molecular Properties

Compound Name3,5-dimethylheptan-3-yloxy(trimethyl)silane
PubChem CID91189399
Molecular FormulaC12H28OSi
Molecular Weight216.44 g/mol
Exact Mass216.19
IUPAC Name3,5-dimethylheptan-3-yloxy(trimethyl)silane
SMILESCCC(C)CC(C)(CC)O[Si](C)(C)C
InChIInChI=1S/C12H28OSi/c1-8-11(3)10-12(4,9-2)13-14(5,6)7/h11H,8-10H2,1-7H3
InChIKeyXSPMABRQYGERDO-UHFFFAOYSA-N
XLogP4.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 54.44
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 3,5-dimethylheptan-3-yloxy(trimethyl)silane?
The IUPAC name of 3,5-dimethylheptan-3-yloxy(trimethyl)silane (CID 91189399) is 3,5-dimethylheptan-3-yloxy(trimethyl)silane.
What is the SMILES notation for 3,5-dimethylheptan-3-yloxy(trimethyl)silane?
The canonical SMILES for 3,5-dimethylheptan-3-yloxy(trimethyl)silane is CCC(C)CC(C)(CC)O[Si](C)(C)C.
What is the InChIKey of 3,5-dimethylheptan-3-yloxy(trimethyl)silane?
The InChIKey is XSPMABRQYGERDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28OSi/c1-8-11(3)10-12(4,9-2)13-14(5,6)7/h11H,8-10H2,1-7H3.
What are the key properties of 3,5-dimethylheptan-3-yloxy(trimethyl)silane?
3,5-dimethylheptan-3-yloxy(trimethyl)silane has a molecular weight of 216.44 g/mol, XLogP of 4.44, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethylheptan-3-yloxy(trimethyl)silane is sourced from PubChem (CID 91189399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).