(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one

C11H22O4Si — CID 11746945

IUPAC(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@H]1O
InChIInChI=1S/C11H22O4Si/c1-11(2,3)16(4,5)14-7-9-8(12)6-10(13)15-9/h8-9,12H,6-7H2,1-5H3/t8-,9-/m1/s1
InChIKeySDCFTMGYNDVBRM-RKDXNWHRSA-N
MW246.38 g/mol
LogP1.68
Rot. Bonds3

About (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one

(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one (PubChem CID 11746945) has the molecular formula C11H22O4Si and a molecular weight of 246.38 g/mol. Its IUPAC name is (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one.

Molecular Properties

Compound Name(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one
PubChem CID11746945
Molecular FormulaC11H22O4Si
Molecular Weight246.38 g/mol
Exact Mass246.13
IUPAC Name(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@H]1O
InChIInChI=1S/C11H22O4Si/c1-11(2,3)16(4,5)14-7-9-8(12)6-10(13)15-9/h8-9,12H,6-7H2,1-5H3/t8-,9-/m1/s1
InChIKeySDCFTMGYNDVBRM-RKDXNWHRSA-N
XLogP1.68
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 51.68
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

4-Trimethylsilyloxy-5-(trimethylsilyloxymethyl)oxolan-2-one
CID 523334
(4R,5R)-4-((tert-Butyldimethylsilyl)oxy)-5-(((tert-butyldimethylsilyl)oxy)methyl)dihydrofuran-2(3H)-one
CID 134973989
(4S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-5-[[tert-butyl(dimethyl)silyl]oxy-hydroxymethyl]-3,3-difluoro-4-hydroxyoxolan-2-one
CID 54307141
(3S,5R)-4-[tert-butyl(dimethyl)silyl]oxy-3-chloro-3-fluoro-5-(hydroxymethyl)oxolan-2-one
CID 173685940
(3S,5R)-3-bromo-4-[tert-butyl(dimethyl)silyl]oxy-3-fluoro-5-(hydroxymethyl)oxolan-2-one
CID 173685944
(5R)-4-[tert-butyl(dimethyl)silyl]oxy-3-chloro-3-fluoro-5-(hydroxymethyl)oxolan-2-one
CID 173793077
(2S,3R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-3-fluorooxolane-2-carboxylic acid
CID 174055708
(2R,3S,4S)-3-[tert-butyl(dimethyl)silyl]oxy-4-fluorooxolane-2-carboxylic acid
CID 174055803
3-[Tert-butyl(dimethyl)silyl]oxy-4-fluorooxolane-2-carboxylic acid
CID 175959005
(6aR,9R,9aS)-9-hydroxy-2,2,4,4-tetra(propan-2-yl)-6,6a,9,9a-tetrahydrofuro[3,2-f][1,3,5,2,4]trioxadisilocin-8-one
CID 54177901
(5R)-5-[(1R)-1-[tert-butyl(dimethyl)silyl]oxy-2-hydroxyethyl]oxolan-2-one
CID 134840108
(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxy-4-methyloxolan-2-one
CID 135014164

Frequently Asked Questions

What is the IUPAC name of (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one?
The IUPAC name of (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one (CID 11746945) is (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one.
What is the SMILES notation for (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one?
The canonical SMILES for (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one is CC(C)(C)[Si](C)(C)OC[C@H]1OC(=O)C[C@H]1O.
What is the InChIKey of (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one?
The InChIKey is SDCFTMGYNDVBRM-RKDXNWHRSA-N. The full InChI is InChI=1S/C11H22O4Si/c1-11(2,3)16(4,5)14-7-9-8(12)6-10(13)15-9/h8-9,12H,6-7H2,1-5H3/t8-,9-/m1/s1.
What are the key properties of (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one?
(4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one has a molecular weight of 246.38 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-hydroxyoxolan-2-one is sourced from PubChem (CID 11746945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).