2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole

C15H28O2Si — CID 10612000

IUPAC2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole
SMILESCC1(C)OCC2=C[Si](C(C)(C)C)(C(C)(C)C)OC21
InChIInChI=1S/C15H28O2Si/c1-13(2,3)18(14(4,5)6)10-11-9-16-15(7,8)12(11)17-18/h10,12H,9H2,1-8H3
InChIKeyQZDSQNKXINYMDL-UHFFFAOYSA-N
MW268.47 g/mol
LogP4.21
Rot. Bonds

About 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole

2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole (PubChem CID 10612000) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole.

Molecular Properties

Compound Name2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole
PubChem CID10612000
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Name2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole
SMILESCC1(C)OCC2=C[Si](C(C)(C)C)(C(C)(C)C)OC21
InChIInChI=1S/C15H28O2Si/c1-13(2,3)18(14(4,5)6)10-11-9-16-15(7,8)12(11)17-18/h10,12H,9H2,1-8H3
InChIKeyQZDSQNKXINYMDL-UHFFFAOYSA-N
XLogP4.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole 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-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole?
The IUPAC name of 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole (CID 10612000) is 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole.
What is the SMILES notation for 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole?
The canonical SMILES for 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole is CC1(C)OCC2=C[Si](C(C)(C)C)(C(C)(C)C)OC21.
What is the InChIKey of 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole?
The InChIKey is QZDSQNKXINYMDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-13(2,3)18(14(4,5)6)10-11-9-16-15(7,8)12(11)17-18/h10,12H,9H2,1-8H3.
What are the key properties of 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole?
2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole has a molecular weight of 268.47 g/mol, XLogP of 4.21, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-ditert-butyl-6,6-dimethyl-4,6a-dihydrofuro[3,4-d]oxasilole is sourced from PubChem (CID 10612000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).