(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol

C15H30O4Si — CID 10357587

IUPAC(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H]1CCC2(OCCO2)[C@H](O)C1
InChIInChI=1S/C15H30O4Si/c1-14(2,3)20(4,5)19-11-12-6-7-15(13(16)10-12)17-8-9-18-15/h12-13,16H,6-11H2,1-5H3/t12-,13-/m1/s1
InChIKeyPLQAORDZFGYFLW-CHWSQXEVSA-N
MW302.49 g/mol
LogP2.91
Rot. Bonds3

About (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol

(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol (PubChem CID 10357587) has the molecular formula C15H30O4Si and a molecular weight of 302.49 g/mol. Its IUPAC name is (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol.

Molecular Properties

Compound Name(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol
PubChem CID10357587
Molecular FormulaC15H30O4Si
Molecular Weight302.49 g/mol
Exact Mass302.19
IUPAC Name(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@@H]1CCC2(OCCO2)[C@H](O)C1
InChIInChI=1S/C15H30O4Si/c1-14(2,3)20(4,5)19-11-12-6-7-15(13(16)10-12)17-8-9-18-15/h12-13,16H,6-11H2,1-5H3/t12-,13-/m1/s1
InChIKeyPLQAORDZFGYFLW-CHWSQXEVSA-N
XLogP2.91
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.49
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(1S,2R,3R,4R,6R)-3-[tert-butyl(dimethyl)silyl]oxy-6-(methoxymethoxy)-4-(methoxymethyl)cyclohexane-1,2-diol
CID 11681830
(1R,2S,3R,4R)-4-[(4R,5S,6R)-6-[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-methylpentane-1,3-diol
CID 53473906
(1S,2S,3S,4R)-4-[(4R,5S,6R)-6-[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxybutan-2-yl]-2,2,5-trimethyl-1,3-dioxan-4-yl]-1-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-methylpentane-1,3-diol
CID 53473909
(5R,6S,7S,8R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-1,3-dioxaspiro[4.5]decane-7,8-diol
CID 101854967
(2S,3S,5R)-1-[tert-butyl(dimethyl)silyl]oxy-5-(2,2-dimethyl-1,3-dioxolan-4-yl)-3-methylhexan-2-ol
CID 134866190
(1r,3s)-5-{[t-Butyl(dimethyl)silyl]oxy}-1-[(2r)-1,4-dioxaspiro[4.5]dec-2-yl]-3-methylpentan-1-ol
CID 175672917
[(3aR,4S,6S,7S,7aR)-6,7-bis[[tert-butyl(dimethyl)silyl]oxy]-2,2-dimethyl-3a,4,5,6,7,7a-hexahydro-1,3-benzodioxol-4-yl]methanol
CID 46188177
(3aS,4R,6R,7aR)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,2-dimethyl-4,5,7,7a-tetrahydro-3aH-1,3-benzodioxole-4,6-diol
CID 59912935
4-(1,3-Dioxolan-2-yl)cyclohexane-1,2-diol
CID 70448692
[(2S,3R,4R,6R)-6-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-methyl-4-tri(propan-2-yl)silyloxyoxan-2-yl]methanol
CID 168193762
2-Ethoxy-5-(1,1,2-triethoxy-2-silylethyl)cyclohexan-1-ol
CID 173635116
4-[1,1-Diethoxy-2-(2-methoxyethoxysilyl)ethyl]-2-(2-methoxyethoxy)cyclohexan-1-ol
CID 173635140

Frequently Asked Questions

What is the IUPAC name of (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol?
The IUPAC name of (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol (CID 10357587) is (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol.
What is the SMILES notation for (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol?
The canonical SMILES for (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol is CC(C)(C)[Si](C)(C)OC[C@@H]1CCC2(OCCO2)[C@H](O)C1.
What is the InChIKey of (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol?
The InChIKey is PLQAORDZFGYFLW-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H30O4Si/c1-14(2,3)20(4,5)19-11-12-6-7-15(13(16)10-12)17-8-9-18-15/h12-13,16H,6-11H2,1-5H3/t12-,13-/m1/s1.
What are the key properties of (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol?
(6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol has a molecular weight of 302.49 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R,8R)-8-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,4-dioxaspiro[4.5]decan-6-ol is sourced from PubChem (CID 10357587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).