1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane

C14H28OSi — CID 568285

IUPAC1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane
SMILESCC[Si]1(OC2CC(C)CC(C)C2)CCCC1
InChIInChI=1S/C14H28OSi/c1-4-16(7-5-6-8-16)15-14-10-12(2)9-13(3)11-14/h12-14H,4-11H2,1-3H3
InChIKeyRGLQCQUFAMVHKJ-UHFFFAOYSA-N
MW240.46 g/mol
LogP4.59
Rot. Bonds3

About 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane

1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane (PubChem CID 568285) has the molecular formula C14H28OSi and a molecular weight of 240.46 g/mol. Its IUPAC name is 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane.

Molecular Properties

Compound Name1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane
PubChem CID568285
Molecular FormulaC14H28OSi
Molecular Weight240.46 g/mol
Exact Mass240.19
IUPAC Name1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane
SMILESCC[Si]1(OC2CC(C)CC(C)C2)CCCC1
InChIInChI=1S/C14H28OSi/c1-4-16(7-5-6-8-16)15-14-10-12(2)9-13(3)11-14/h12-14H,4-11H2,1-3H3
InChIKeyRGLQCQUFAMVHKJ-UHFFFAOYSA-N
XLogP4.59
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 ≤ 54.59
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-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane?
The IUPAC name of 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane (CID 568285) is 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane.
What is the SMILES notation for 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane?
The canonical SMILES for 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane is CC[Si]1(OC2CC(C)CC(C)C2)CCCC1.
What is the InChIKey of 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane?
The InChIKey is RGLQCQUFAMVHKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28OSi/c1-4-16(7-5-6-8-16)15-14-10-12(2)9-13(3)11-14/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane?
1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane has a molecular weight of 240.46 g/mol, XLogP of 4.59, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylcyclohexyl)oxy-1-ethylsilolane is sourced from PubChem (CID 568285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).