2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane

C17H38O2Si2 — CID 173240237

IUPAC2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane
SMILESCC(C)(C)C(C)(C)[SiH]1CCCCO1.C[Si]1(C)CCCCO1
InChIInChI=1S/C11H24OSi.C6H14OSi/c1-10(2,3)11(4,5)13-9-7-6-8-12-13;1-8(2)6-4-3-5-7-8/h13H,6-9H2,1-5H3;3-6H2,1-2H3
InChIKeyQTOLOIYGLPXMBM-UHFFFAOYSA-N
MW330.66 g/mol
LogP5.35
Rot. Bonds1

About 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane

2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane (PubChem CID 173240237) has the molecular formula C17H38O2Si2 and a molecular weight of 330.66 g/mol. Its IUPAC name is 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane.

Molecular Properties

Compound Name2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane
PubChem CID173240237
Molecular FormulaC17H38O2Si2
Molecular Weight330.66 g/mol
Exact Mass330.24
IUPAC Name2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane
SMILESCC(C)(C)C(C)(C)[SiH]1CCCCO1.C[Si]1(C)CCCCO1
InChIInChI=1S/C11H24OSi.C6H14OSi/c1-10(2,3)11(4,5)13-9-7-6-8-12-13;1-8(2)6-4-3-5-7-8/h13H,6-9H2,1-5H3;3-6H2,1-2H3
InChIKeyQTOLOIYGLPXMBM-UHFFFAOYSA-N
XLogP5.35
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.66
LogP ≤ 55.35
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 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane?
The IUPAC name of 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane (CID 173240237) is 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane.
What is the SMILES notation for 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane?
The canonical SMILES for 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane is CC(C)(C)C(C)(C)[SiH]1CCCCO1.C[Si]1(C)CCCCO1.
What is the InChIKey of 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane?
The InChIKey is QTOLOIYGLPXMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OSi.C6H14OSi/c1-10(2,3)11(4,5)13-9-7-6-8-12-13;1-8(2)6-4-3-5-7-8/h13H,6-9H2,1-5H3;3-6H2,1-2H3.
What are the key properties of 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane?
2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane has a molecular weight of 330.66 g/mol, XLogP of 5.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyloxasilinane;2-(2,3,3-trimethylbutan-2-yl)oxasilinane is sourced from PubChem (CID 173240237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).