(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol

C11H24O4Si — CID 56997357

IUPAC(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol
SMILESCC(C)(C)[Si](C)(C)[C@]1(O)CO[C@H](CO)[C@H]1O
InChIInChI=1S/C11H24O4Si/c1-10(2,3)16(4,5)11(14)7-15-8(6-12)9(11)13/h8-9,12-14H,6-7H2,1-5H3/t8-,9-,11-/m1/s1
InChIKeyQOAFZJFOVXRZDH-FXPVBKGRSA-N
MW248.39 g/mol
LogP0.52
Rot. Bonds2

About (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol

(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol (PubChem CID 56997357) has the molecular formula C11H24O4Si and a molecular weight of 248.39 g/mol. Its IUPAC name is (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol.

Molecular Properties

Compound Name(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol
PubChem CID56997357
Molecular FormulaC11H24O4Si
Molecular Weight248.39 g/mol
Exact Mass248.14
IUPAC Name(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol
SMILESCC(C)(C)[Si](C)(C)[C@]1(O)CO[C@H](CO)[C@H]1O
InChIInChI=1S/C11H24O4Si/c1-10(2,3)16(4,5)11(14)7-15-8(6-12)9(11)13/h8-9,12-14H,6-7H2,1-5H3/t8-,9-,11-/m1/s1
InChIKeyQOAFZJFOVXRZDH-FXPVBKGRSA-N
XLogP0.52
TPSA69.92 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 50.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2R,3R,4R)-2-(hydroxymethyl)-4-methyloxolane-3,4-diol
CID 91038054
(3R,4R)-2-(hydroxymethyl)-4-methyloxolane-3,4-diol
CID 91418847
(2R,3R,4S)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)-2,3-dihydropyran-3,4-diol
CID 91063732
(2R,3R)-4-chloro-2-(hydroxymethyl)-4-methyloxolan-3-ol
CID 150843883
(2R,3R,4S,5R)-2-(hydroxymethyl)-5-iodooxane-3,4,5-triol
CID 91589098
(4R,5S)-6-(hydroxymethyl)oxane-3,3,4,5-tetrol
CID 59927511
4-ethynyl-2-(hydroxymethyl)oxolane-3,4-diol
CID 91145820
(2R,4R,5S)-2-(hydroxymethyl)-4-methyloxane-3,4,5-triol
CID 91029782
N-[(3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 54288562
methyl (3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-3-carboxylate
CID 91074786
N-[(3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
CID 69476720
(2R,3R,4R,5R)-2-(hydroxymethyl)-4,5-bis[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxane-3,4,5-triol
CID 57076968

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol?
The IUPAC name of (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol (CID 56997357) is (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol.
What is the SMILES notation for (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol?
The canonical SMILES for (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol is CC(C)(C)[Si](C)(C)[C@]1(O)CO[C@H](CO)[C@H]1O.
What is the InChIKey of (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol?
The InChIKey is QOAFZJFOVXRZDH-FXPVBKGRSA-N. The full InChI is InChI=1S/C11H24O4Si/c1-10(2,3)16(4,5)11(14)7-15-8(6-12)9(11)13/h8-9,12-14H,6-7H2,1-5H3/t8-,9-,11-/m1/s1.
What are the key properties of (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol?
(2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol has a molecular weight of 248.39 g/mol, XLogP of 0.52, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R)-4-[tert-butyl(dimethyl)silyl]-2-(hydroxymethyl)oxolane-3,4-diol is sourced from PubChem (CID 56997357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).