[4-(cyclohexen-1-yl)phenoxy]methylsilane

C13H18OSi — CID 160586501

IUPAC[4-(cyclohexen-1-yl)phenoxy]methylsilane
SMILES[SiH3]COc1ccc(C2=CCCCC2)cc1
InChIInChI=1S/C13H18OSi/c15-10-14-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h4,6-9H,1-3,5,10H2,15H3
InChIKeyHIJQEOMSJCQEAN-UHFFFAOYSA-N
MW218.37 g/mol
LogP2.35
Rot. Bonds3

About [4-(cyclohexen-1-yl)phenoxy]methylsilane

[4-(cyclohexen-1-yl)phenoxy]methylsilane (PubChem CID 160586501) has the molecular formula C13H18OSi and a molecular weight of 218.37 g/mol. Its IUPAC name is [4-(cyclohexen-1-yl)phenoxy]methylsilane.

Molecular Properties

Compound Name[4-(cyclohexen-1-yl)phenoxy]methylsilane
PubChem CID160586501
Molecular FormulaC13H18OSi
Molecular Weight218.37 g/mol
Exact Mass218.11
IUPAC Name[4-(cyclohexen-1-yl)phenoxy]methylsilane
SMILES[SiH3]COc1ccc(C2=CCCCC2)cc1
InChIInChI=1S/C13H18OSi/c15-10-14-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h4,6-9H,1-3,5,10H2,15H3
InChIKeyHIJQEOMSJCQEAN-UHFFFAOYSA-N
XLogP2.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.37
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [4-(cyclohexen-1-yl)phenoxy]methylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(cyclohexen-1-yl)phenoxy]methylsilane?
The IUPAC name of [4-(cyclohexen-1-yl)phenoxy]methylsilane (CID 160586501) is [4-(cyclohexen-1-yl)phenoxy]methylsilane.
What is the SMILES notation for [4-(cyclohexen-1-yl)phenoxy]methylsilane?
The canonical SMILES for [4-(cyclohexen-1-yl)phenoxy]methylsilane is [SiH3]COc1ccc(C2=CCCCC2)cc1.
What is the InChIKey of [4-(cyclohexen-1-yl)phenoxy]methylsilane?
The InChIKey is HIJQEOMSJCQEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18OSi/c15-10-14-13-8-6-12(7-9-13)11-4-2-1-3-5-11/h4,6-9H,1-3,5,10H2,15H3.
What are the key properties of [4-(cyclohexen-1-yl)phenoxy]methylsilane?
[4-(cyclohexen-1-yl)phenoxy]methylsilane has a molecular weight of 218.37 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclohexen-1-yl)phenoxy]methylsilane is sourced from PubChem (CID 160586501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).