(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one

C11H22O3Si — CID 173164127

IUPAC(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one
SMILESC[SiH](C)C(O)([C@@H]1CCC(=O)O1)C(C)(C)C
InChIInChI=1S/C11H22O3Si/c1-10(2,3)11(13,15(4)5)8-6-7-9(12)14-8/h8,13,15H,6-7H2,1-5H3/t8-,11?/m0/s1
InChIKeyFWLBIDHSIPYAOY-YMNIQAILSA-N
MW230.38 g/mol
LogP1.50
Rot. Bonds2

About (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one

(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one (PubChem CID 173164127) has the molecular formula C11H22O3Si and a molecular weight of 230.38 g/mol. Its IUPAC name is (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one.

Molecular Properties

Compound Name(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one
PubChem CID173164127
Molecular FormulaC11H22O3Si
Molecular Weight230.38 g/mol
Exact Mass230.13
IUPAC Name(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one
SMILESC[SiH](C)C(O)([C@@H]1CCC(=O)O1)C(C)(C)C
InChIInChI=1S/C11H22O3Si/c1-10(2,3)11(13,15(4)5)8-6-7-9(12)14-8/h8,13,15H,6-7H2,1-5H3/t8-,11?/m0/s1
InChIKeyFWLBIDHSIPYAOY-YMNIQAILSA-N
XLogP1.50
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(5S)-5-(2-hydroxypropan-2-yl)oxolan-2-one
CID 12872230
(5S)-5-(1,1,2,2,2-pentafluoroethyl)oxolan-2-one
CID 10921609
6-tert-butyloxan-2-one;ethane
CID 144908512
ethyl 2-iodo-2-[(2R)-5-oxooxolan-2-yl]propanoate
CID 15642349
(5R)-5-prop-1-en-2-yloxolan-2-one
CID 12914394
methyl (2R)-2-hydroxy-2-(4-methoxyphenyl)-2-[(2R)-5-oxooxolan-2-yl]acetate
CID 177408752
5-methyloxolan-2-one
CID 69397003
methyl 5-oxooxolane-2-carboxylate
CID 558879
5-(1-chloro-2-methylprop-1-enyl)oxolan-2-one
CID 13416543
5-[[tert-butyl(dimethyl)silyl]-hydroxymethyl]oxolan-2-one
CID 69374785
(5-oxooxolan-2-yl) 2-iodo-2-methylbutanoate
CID 138474302
tert-butyl 4-oxo-4-[(2S)-5-oxooxolan-2-yl]butanoate
CID 58491678

Frequently Asked Questions

What is the IUPAC name of (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one?
The IUPAC name of (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one (CID 173164127) is (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one.
What is the SMILES notation for (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one?
The canonical SMILES for (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one is C[SiH](C)C(O)([C@@H]1CCC(=O)O1)C(C)(C)C.
What is the InChIKey of (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one?
The InChIKey is FWLBIDHSIPYAOY-YMNIQAILSA-N. The full InChI is InChI=1S/C11H22O3Si/c1-10(2,3)11(13,15(4)5)8-6-7-9(12)14-8/h8,13,15H,6-7H2,1-5H3/t8-,11?/m0/s1.
What are the key properties of (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one?
(5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one has a molecular weight of 230.38 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-(1-dimethylsilyl-1-hydroxy-2,2-dimethylpropyl)oxolan-2-one is sourced from PubChem (CID 173164127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).