4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol

C10H23O2Si+ — CID 135430450

IUPAC4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol
SMILESCC(C)(C)[Si](C)(C)OCC[CH+]CO
InChIInChI=1S/C10H23O2Si/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6,11H,7-9H2,1-5H3/q+1
InChIKeyROOWPTHCEWBDFB-UHFFFAOYSA-N
MW203.38 g/mol
LogP2.59
Rot. Bonds5

About 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol

4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol (PubChem CID 135430450) has the molecular formula C10H23O2Si+ and a molecular weight of 203.38 g/mol. Its IUPAC name is 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol.

Molecular Properties

Compound Name4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol
PubChem CID135430450
Molecular FormulaC10H23O2Si+
Molecular Weight203.38 g/mol
Exact Mass203.15
IUPAC Name4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol
SMILESCC(C)(C)[Si](C)(C)OCC[CH+]CO
InChIInChI=1S/C10H23O2Si/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6,11H,7-9H2,1-5H3/q+1
InChIKeyROOWPTHCEWBDFB-UHFFFAOYSA-N
XLogP2.59
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.38
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

22-[tert-butyl(dimethyl)silyl]oxydocosan-1-ol
CID 15229755
8-[tert-butyl(dimethyl)silyl]oxyoctan-1-ol
CID 11043515
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
O-[2-[tert-butyl(dimethyl)silyl]oxyethyl]hydroxylamine
CID 23132349
10-[tert-butyl(dimethyl)silyl]oxy-1,1-dideuteriodecan-1-ol
CID 102212924
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595
3-[tert-butyl(dimethyl)silyl]oxy-1,1,2,2,3,3-hexadeuteriopropan-1-ol
CID 71777166
7-[tert-butyl(dimethyl)silyl]oxy-5,5-dimethylheptan-1-ol
CID 21261679
[4-[2-[tert-butyl(dimethyl)silyl]oxyethyl]cyclohexyl]methanol
CID 140982899
3-[2-[tert-butyl(dimethyl)silyl]oxyethylamino]propan-1-ol
CID 156692863

Frequently Asked Questions

What is the IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol?
The IUPAC name of 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol (CID 135430450) is 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol.
What is the SMILES notation for 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol?
The canonical SMILES for 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol is CC(C)(C)[Si](C)(C)OCC[CH+]CO.
What is the InChIKey of 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol?
The InChIKey is ROOWPTHCEWBDFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23O2Si/c1-10(2,3)13(4,5)12-9-7-6-8-11/h6,11H,7-9H2,1-5H3/q+1.
What are the key properties of 4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol?
4-[tert-butyl(dimethyl)silyl]oxybutan-1-ol has a molecular weight of 203.38 g/mol, XLogP of 2.59, 5 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]oxybutan-1-ol is sourced from PubChem (CID 135430450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).