[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol

C16H34O2Si2 — CID 138756386

IUPAC[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H]1C=C[C@@H]([Si](C)(C)C)[C@@H]1CO
InChIInChI=1S/C16H34O2Si2/c1-16(2,3)20(7,8)18-12-13-9-10-15(14(13)11-17)19(4,5)6/h9-10,13-15,17H,11-12H2,1-8H3/t13-,14+,15+/m0/s1
InChIKeyBAZGFYLZBBREPA-RRFJBIMHSA-N
MW314.62 g/mol
LogP4.51
Rot. Bonds5

About [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol

[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol (PubChem CID 138756386) has the molecular formula C16H34O2Si2 and a molecular weight of 314.62 g/mol. Its IUPAC name is [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol.

Molecular Properties

Compound Name[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol
PubChem CID138756386
Molecular FormulaC16H34O2Si2
Molecular Weight314.62 g/mol
Exact Mass314.21
IUPAC Name[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H]1C=C[C@@H]([Si](C)(C)C)[C@@H]1CO
InChIInChI=1S/C16H34O2Si2/c1-16(2,3)20(7,8)18-12-13-9-10-15(14(13)11-17)19(4,5)6/h9-10,13-15,17H,11-12H2,1-8H3/t13-,14+,15+/m0/s1
InChIKeyBAZGFYLZBBREPA-RRFJBIMHSA-N
XLogP4.51
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.62
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol?
The IUPAC name of [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol (CID 138756386) is [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol.
What is the SMILES notation for [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol?
The canonical SMILES for [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol is CC(C)(C)[Si](C)(C)OC[C@@H]1C=C[C@@H]([Si](C)(C)C)[C@@H]1CO.
What is the InChIKey of [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol?
The InChIKey is BAZGFYLZBBREPA-RRFJBIMHSA-N. The full InChI is InChI=1S/C16H34O2Si2/c1-16(2,3)20(7,8)18-12-13-9-10-15(14(13)11-17)19(4,5)6/h9-10,13-15,17H,11-12H2,1-8H3/t13-,14+,15+/m0/s1.
What are the key properties of [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol?
[(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol has a molecular weight of 314.62 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2R,5R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-5-trimethylsilylcyclopent-3-en-1-yl]methanol is sourced from PubChem (CID 138756386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).