[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane

C13H24OSi — CID 123470446

IUPAC[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane
SMILES[SiH3]C1(CCC2=CCCCC2)CCCCO1
InChIInChI=1S/C13H24OSi/c15-13(9-4-5-11-14-13)10-8-12-6-2-1-3-7-12/h6H,1-5,7-11H2,15H3
InChIKeyIDHQLVVZMGCHNP-UHFFFAOYSA-N
MW224.42 g/mol
LogP2.53
Rot. Bonds3

About [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane

[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane (PubChem CID 123470446) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane.

Molecular Properties

Compound Name[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane
PubChem CID123470446
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane
SMILES[SiH3]C1(CCC2=CCCCC2)CCCCO1
InChIInChI=1S/C13H24OSi/c15-13(9-4-5-11-14-13)10-8-12-6-2-1-3-7-12/h6H,1-5,7-11H2,15H3
InChIKeyIDHQLVVZMGCHNP-UHFFFAOYSA-N
XLogP2.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane?
The IUPAC name of [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane (CID 123470446) is [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane.
What is the SMILES notation for [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane?
The canonical SMILES for [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane is [SiH3]C1(CCC2=CCCCC2)CCCCO1.
What is the InChIKey of [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane?
The InChIKey is IDHQLVVZMGCHNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c15-13(9-4-5-11-14-13)10-8-12-6-2-1-3-7-12/h6H,1-5,7-11H2,15H3.
What are the key properties of [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane?
[2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane has a molecular weight of 224.42 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[2-(cyclohexen-1-yl)ethyl]oxan-2-yl]silane is sourced from PubChem (CID 123470446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).