(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane

C12H23FOSi — CID 123575538

IUPAC(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCC(C)C1CCC(O[Si](C)(C)C)=C(F)C1
InChIInChI=1S/C12H23FOSi/c1-9(2)10-6-7-12(11(13)8-10)14-15(3,4)5/h9-10H,6-8H2,1-5H3
InChIKeySUZKLQBIKPCBFA-UHFFFAOYSA-N
MW230.40 g/mol
LogP4.48
Rot. Bonds3

About (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane

(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane (PubChem CID 123575538) has the molecular formula C12H23FOSi and a molecular weight of 230.40 g/mol. Its IUPAC name is (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane
PubChem CID123575538
Molecular FormulaC12H23FOSi
Molecular Weight230.40 g/mol
Exact Mass230.15
IUPAC Name(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane
SMILESCC(C)C1CCC(O[Si](C)(C)C)=C(F)C1
InChIInChI=1S/C12H23FOSi/c1-9(2)10-6-7-12(11(13)8-10)14-15(3,4)5/h9-10H,6-8H2,1-5H3
InChIKeySUZKLQBIKPCBFA-UHFFFAOYSA-N
XLogP4.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.40
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane 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 (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane?
The IUPAC name of (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane (CID 123575538) is (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane.
What is the SMILES notation for (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane?
The canonical SMILES for (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane is CC(C)C1CCC(O[Si](C)(C)C)=C(F)C1.
What is the InChIKey of (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane?
The InChIKey is SUZKLQBIKPCBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23FOSi/c1-9(2)10-6-7-12(11(13)8-10)14-15(3,4)5/h9-10H,6-8H2,1-5H3.
What are the key properties of (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane?
(2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane has a molecular weight of 230.40 g/mol, XLogP of 4.48, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-propan-2-ylcyclohexen-1-yl)oxy-trimethylsilane is sourced from PubChem (CID 123575538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).