[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol

C16H32O2Si — CID 171844363

IUPAC[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC1CCC(CO)C12CCCC2
InChIInChI=1S/C16H32O2Si/c1-15(2,3)19(4,5)18-14-9-8-13(12-17)16(14)10-6-7-11-16/h13-14,17H,6-12H2,1-5H3
InChIKeyVAQCGHOYLFJVQD-UHFFFAOYSA-N
MW284.52 g/mol
LogP4.34
Rot. Bonds3

About [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol

[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol (PubChem CID 171844363) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol.

Molecular Properties

Compound Name[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol
PubChem CID171844363
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC1CCC(CO)C12CCCC2
InChIInChI=1S/C16H32O2Si/c1-15(2,3)19(4,5)18-14-9-8-13(12-17)16(14)10-6-7-11-16/h13-14,17H,6-12H2,1-5H3
InChIKeyVAQCGHOYLFJVQD-UHFFFAOYSA-N
XLogP4.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.52
LogP ≤ 54.34
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]oxyspiro[4.4]nonan-1-yl]methanol?
The IUPAC name of [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol (CID 171844363) is [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol.
What is the SMILES notation for [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol?
The canonical SMILES for [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol is CC(C)(C)[Si](C)(C)OC1CCC(CO)C12CCCC2.
What is the InChIKey of [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol?
The InChIKey is VAQCGHOYLFJVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-15(2,3)19(4,5)18-14-9-8-13(12-17)16(14)10-6-7-11-16/h13-14,17H,6-12H2,1-5H3.
What are the key properties of [4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol?
[4-[tert-butyl(dimethyl)silyl]oxyspiro[4.4]nonan-1-yl]methanol has a molecular weight of 284.52 g/mol, XLogP of 4.34, 3 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]oxyspiro[4.4]nonan-1-yl]methanol is sourced from PubChem (CID 171844363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).