3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol

C11H26O2Si — CID 134840807

IUPAC3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
SMILESCC(C)(CCO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(2,3)14(6,7)13-11(4,5)8-9-12/h12H,8-9H2,1-7H3
InChIKeyARFRYZMIUZQLTL-UHFFFAOYSA-N
MW218.41 g/mol
LogP3.17
Rot. Bonds4

About 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol

3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol (PubChem CID 134840807) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol.

Molecular Properties

Compound Name3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
PubChem CID134840807
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol
SMILESCC(C)(CCO)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(2,3)14(6,7)13-11(4,5)8-9-12/h12H,8-9H2,1-7H3
InChIKeyARFRYZMIUZQLTL-UHFFFAOYSA-N
XLogP3.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 53.17
H-Bond Donors ≤ 51
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 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The IUPAC name of 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol (CID 134840807) is 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol.
What is the SMILES notation for 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The canonical SMILES for 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol is CC(C)(CCO)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
The InChIKey is ARFRYZMIUZQLTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-10(2,3)14(6,7)13-11(4,5)8-9-12/h12H,8-9H2,1-7H3.
What are the key properties of 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol?
3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol has a molecular weight of 218.41 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[tert-butyl(dimethyl)silyl]oxy-3-methylbutan-1-ol is sourced from PubChem (CID 134840807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).