2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane

C16H26OSi — CID 174648738

IUPAC2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane
SMILESCC1(C)O[Si](C)(C)CC(c2ccccc2)C1(C)C
InChIInChI=1S/C16H26OSi/c1-15(2)14(13-10-8-7-9-11-13)12-18(5,6)17-16(15,3)4/h7-11,14H,12H2,1-6H3
InChIKeyPLSVNYIVSZDVGL-UHFFFAOYSA-N
MW262.47 g/mol
LogP4.81
Rot. Bonds1

About 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane

2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane (PubChem CID 174648738) has the molecular formula C16H26OSi and a molecular weight of 262.47 g/mol. Its IUPAC name is 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane.

Molecular Properties

Compound Name2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane
PubChem CID174648738
Molecular FormulaC16H26OSi
Molecular Weight262.47 g/mol
Exact Mass262.18
IUPAC Name2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane
SMILESCC1(C)O[Si](C)(C)CC(c2ccccc2)C1(C)C
InChIInChI=1S/C16H26OSi/c1-15(2)14(13-10-8-7-9-11-13)12-18(5,6)17-16(15,3)4/h7-11,14H,12H2,1-6H3
InChIKeyPLSVNYIVSZDVGL-UHFFFAOYSA-N
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.47
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane 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 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane?
The IUPAC name of 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane (CID 174648738) is 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane.
What is the SMILES notation for 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane?
The canonical SMILES for 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane is CC1(C)O[Si](C)(C)CC(c2ccccc2)C1(C)C.
What is the InChIKey of 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane?
The InChIKey is PLSVNYIVSZDVGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26OSi/c1-15(2)14(13-10-8-7-9-11-13)12-18(5,6)17-16(15,3)4/h7-11,14H,12H2,1-6H3.
What are the key properties of 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane?
2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane has a molecular weight of 262.47 g/mol, XLogP of 4.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5,6,6-hexamethyl-4-phenyloxasilinane is sourced from PubChem (CID 174648738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).