4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol

C17H44OSi4 — CID 18684363

IUPAC4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol
SMILESCC(C)(O)CC[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H44OSi4/c1-16(2,18)14-15-22(12,13)17(19(3,4)5,20(6,7)8)21(9,10)11/h18H,14-15H2,1-13H3
InChIKeyWNWDTQGADHXHPI-UHFFFAOYSA-N
MW376.88 g/mol
LogP6.23
Rot. Bonds7

About 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol

4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol (PubChem CID 18684363) has the molecular formula C17H44OSi4 and a molecular weight of 376.88 g/mol. Its IUPAC name is 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol.

Molecular Properties

Compound Name4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol
PubChem CID18684363
Molecular FormulaC17H44OSi4
Molecular Weight376.88 g/mol
Exact Mass376.25
IUPAC Name4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol
SMILESCC(C)(O)CC[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C17H44OSi4/c1-16(2,18)14-15-22(12,13)17(19(3,4)5,20(6,7)8)21(9,10)11/h18H,14-15H2,1-13H3
InChIKeyWNWDTQGADHXHPI-UHFFFAOYSA-N
XLogP6.23
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.88
LogP ≤ 56.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol?
The IUPAC name of 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol (CID 18684363) is 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol.
What is the SMILES notation for 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol?
The canonical SMILES for 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol is CC(C)(O)CC[Si](C)(C)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol?
The InChIKey is WNWDTQGADHXHPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H44OSi4/c1-16(2,18)14-15-22(12,13)17(19(3,4)5,20(6,7)8)21(9,10)11/h18H,14-15H2,1-13H3.
What are the key properties of 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol?
4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol has a molecular weight of 376.88 g/mol, XLogP of 6.23, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[dimethyl-[tris(trimethylsilyl)methyl]silyl]-2-methylbutan-2-ol is sourced from PubChem (CID 18684363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).