2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane

C12H18O2Si — CID 14148970

IUPAC2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane
SMILESCC1CC(C)O[Si](C)(c2ccccc2)O1
InChIInChI=1S/C12H18O2Si/c1-10-9-11(2)14-15(3,13-10)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKeyRUVFMVYUTQGDCN-UHFFFAOYSA-N
MW222.36 g/mol
LogP2.18
Rot. Bonds1

About 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane

2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane (PubChem CID 14148970) has the molecular formula C12H18O2Si and a molecular weight of 222.36 g/mol. Its IUPAC name is 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane.

Molecular Properties

Compound Name2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane
PubChem CID14148970
Molecular FormulaC12H18O2Si
Molecular Weight222.36 g/mol
Exact Mass222.11
IUPAC Name2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane
SMILESCC1CC(C)O[Si](C)(c2ccccc2)O1
InChIInChI=1S/C12H18O2Si/c1-10-9-11(2)14-15(3,13-10)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3
InChIKeyRUVFMVYUTQGDCN-UHFFFAOYSA-N
XLogP2.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.36
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane?
The IUPAC name of 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane (CID 14148970) is 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane.
What is the SMILES notation for 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane?
The canonical SMILES for 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane is CC1CC(C)O[Si](C)(c2ccccc2)O1.
What is the InChIKey of 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane?
The InChIKey is RUVFMVYUTQGDCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O2Si/c1-10-9-11(2)14-15(3,13-10)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3.
What are the key properties of 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane?
2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane has a molecular weight of 222.36 g/mol, XLogP of 2.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-2-phenyl-1,3,2-dioxasilinane is sourced from PubChem (CID 14148970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).