[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol

C17H34O4Si — CID 59917799

IUPAC[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCC1CCCC2(CCC[C@H](CO)O2)O1
InChIInChI=1S/C17H34O4Si/c1-16(2,3)22(4,5)19-13-15-9-7-11-17(21-15)10-6-8-14(12-18)20-17/h14-15,18H,6-13H2,1-5H3/t14-,15?,17?/m1/s1
InChIKeyIMJAOOLOMRCDLG-HPUBIQBYSA-N
MW330.54 g/mol
LogP3.84
Rot. Bonds4

About [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol

[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol (PubChem CID 59917799) has the molecular formula C17H34O4Si and a molecular weight of 330.54 g/mol. Its IUPAC name is [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol.

Molecular Properties

Compound Name[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol
PubChem CID59917799
Molecular FormulaC17H34O4Si
Molecular Weight330.54 g/mol
Exact Mass330.22
IUPAC Name[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCC1CCCC2(CCC[C@H](CO)O2)O1
InChIInChI=1S/C17H34O4Si/c1-16(2,3)22(4,5)19-13-15-9-7-11-17(21-15)10-6-8-14(12-18)20-17/h14-15,18H,6-13H2,1-5H3/t14-,15?,17?/m1/s1
InChIKeyIMJAOOLOMRCDLG-HPUBIQBYSA-N
XLogP3.84
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.54
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol?
The IUPAC name of [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol (CID 59917799) is [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol.
What is the SMILES notation for [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol?
The canonical SMILES for [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol is CC(C)(C)[Si](C)(C)OCC1CCCC2(CCC[C@H](CO)O2)O1.
What is the InChIKey of [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol?
The InChIKey is IMJAOOLOMRCDLG-HPUBIQBYSA-N. The full InChI is InChI=1S/C17H34O4Si/c1-16(2,3)22(4,5)19-13-15-9-7-11-17(21-15)10-6-8-14(12-18)20-17/h14-15,18H,6-13H2,1-5H3/t14-,15?,17?/m1/s1.
What are the key properties of [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol?
[(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol has a molecular weight of 330.54 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(8R)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,7-dioxaspiro[5.5]undecan-8-yl]methanol is sourced from PubChem (CID 59917799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).