5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol

C11H26O2Si — CID 10998500

IUPAC5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
SMILESCC(O)CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(12)8-7-9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3
InChIKeyGAAOKOSJNUIMRV-UHFFFAOYSA-N
MW218.41 g/mol
LogP3.17
Rot. Bonds5

About 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol

5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol (PubChem CID 10998500) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol.

Molecular Properties

Compound Name5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
PubChem CID10998500
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol
SMILESCC(O)CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H26O2Si/c1-10(12)8-7-9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3
InChIKeyGAAOKOSJNUIMRV-UHFFFAOYSA-N
XLogP3.17
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol?
The IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol (CID 10998500) is 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol.
What is the SMILES notation for 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol?
The canonical SMILES for 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol is CC(O)CCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol?
The InChIKey is GAAOKOSJNUIMRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-10(12)8-7-9-13-14(5,6)11(2,3)4/h10,12H,7-9H2,1-6H3.
What are the key properties of 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol?
5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol has a molecular weight of 218.41 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(dimethyl)silyl]oxypentan-2-ol is sourced from PubChem (CID 10998500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).