1-(2-ethylcyclohexyl)oxy-1-methylsilinane

C14H28OSi — CID 574878

IUPAC1-(2-ethylcyclohexyl)oxy-1-methylsilinane
SMILESCCC1CCCCC1O[Si]1(C)CCCCC1
InChIInChI=1S/C14H28OSi/c1-3-13-9-5-6-10-14(13)15-16(2)11-7-4-8-12-16/h13-14H,3-12H2,1-2H3
InChIKeyHTLYQECJTPECRC-UHFFFAOYSA-N
MW240.46 g/mol
LogP4.73
Rot. Bonds3

About 1-(2-ethylcyclohexyl)oxy-1-methylsilinane

1-(2-ethylcyclohexyl)oxy-1-methylsilinane (PubChem CID 574878) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is 1-(2-ethylcyclohexyl)oxy-1-methylsilinane.

Molecular Properties

Compound Name1-(2-ethylcyclohexyl)oxy-1-methylsilinane
PubChem CID574878
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Name1-(2-ethylcyclohexyl)oxy-1-methylsilinane
SMILESCCC1CCCCC1O[Si]1(C)CCCCC1
InChIInChI=1S/C14H28OSi/c1-3-13-9-5-6-10-14(13)15-16(2)11-7-4-8-12-16/h13-14H,3-12H2,1-2H3
InChIKeyHTLYQECJTPECRC-UHFFFAOYSA-N
XLogP4.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.46
LogP ≤ 54.73
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 1-(2-ethylcyclohexyl)oxy-1-methylsilinane?
The IUPAC name of 1-(2-ethylcyclohexyl)oxy-1-methylsilinane (CID 574878) is 1-(2-ethylcyclohexyl)oxy-1-methylsilinane.
What is the SMILES notation for 1-(2-ethylcyclohexyl)oxy-1-methylsilinane?
The canonical SMILES for 1-(2-ethylcyclohexyl)oxy-1-methylsilinane is CCC1CCCCC1O[Si]1(C)CCCCC1.
What is the InChIKey of 1-(2-ethylcyclohexyl)oxy-1-methylsilinane?
The InChIKey is HTLYQECJTPECRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28OSi/c1-3-13-9-5-6-10-14(13)15-16(2)11-7-4-8-12-16/h13-14H,3-12H2,1-2H3.
What are the key properties of 1-(2-ethylcyclohexyl)oxy-1-methylsilinane?
1-(2-ethylcyclohexyl)oxy-1-methylsilinane has a molecular weight of 240.46 g/mol, XLogP of 4.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylcyclohexyl)oxy-1-methylsilinane is sourced from PubChem (CID 574878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).