4-[tert-butyl(dimethyl)silyl]oxyphenol

C12H20O2Si — CID 597388

IUPAC4-[tert-butyl(dimethyl)silyl]oxyphenol
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(O)cc1
InChIInChI=1S/C12H20O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h6-9,13H,1-5H3
InChIKeyKZTVHIZALLBXMO-UHFFFAOYSA-N
MW224.38 g/mol
LogP3.78
Rot. Bonds2

About 4-[tert-butyl(dimethyl)silyl]oxyphenol

4-[tert-butyl(dimethyl)silyl]oxyphenol (PubChem CID 597388) has the molecular formula C12H20O2Si and a molecular weight of 224.38 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxyphenol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxyphenol
PubChem CID597388
Molecular FormulaC12H20O2Si
Molecular Weight224.38 g/mol
Exact Mass224.12
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxyphenol
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(O)cc1
InChIInChI=1S/C12H20O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h6-9,13H,1-5H3
InChIKeyKZTVHIZALLBXMO-UHFFFAOYSA-N
XLogP3.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.38
LogP ≤ 53.78
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 4-[tert-butyl(dimethyl)silyl]oxyphenol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxyphenol (CID 597388) is 4-[tert-butyl(dimethyl)silyl]oxyphenol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxyphenol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxyphenol is CC(C)(C)[Si](C)(C)Oc1ccc(O)cc1.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxyphenol?
The InChIKey is KZTVHIZALLBXMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2Si/c1-12(2,3)15(4,5)14-11-8-6-10(13)7-9-11/h6-9,13H,1-5H3.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxyphenol?
4-[tert-butyl(dimethyl)silyl]oxyphenol has a molecular weight of 224.38 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[tert-butyl(dimethyl)silyl]oxyphenol is sourced from PubChem (CID 597388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).