[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol

C16H38O6Si3 — CID 11047886

IUPAC[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol
SMILESCO[C@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C
InChIInChI=1S/C16H38O6Si3/c1-18-16-15(22-25(8,9)10)14(21-24(5,6)7)13(12(11-17)19-16)20-23(2,3)4/h12-17H,11H2,1-10H3/t12-,13-,14+,15-,16+/m1/s1
InChIKeyVFMWHUHHZDIWSF-LJIZCISZSA-N
MW410.73 g/mol
LogP3.01
Rot. Bonds8

About [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol

[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol (PubChem CID 11047886) has the molecular formula C16H38O6Si3 and a molecular weight of 410.73 g/mol. Its IUPAC name is [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol.

Molecular Properties

Compound Name[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol
PubChem CID11047886
Molecular FormulaC16H38O6Si3
Molecular Weight410.73 g/mol
Exact Mass410.20
IUPAC Name[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol
SMILESCO[C@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C
InChIInChI=1S/C16H38O6Si3/c1-18-16-15(22-25(8,9)10)14(21-24(5,6)7)13(12(11-17)19-16)20-23(2,3)4/h12-17H,11H2,1-10H3/t12-,13-,14+,15-,16+/m1/s1
InChIKeyVFMWHUHHZDIWSF-LJIZCISZSA-N
XLogP3.01
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.73
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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 [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol?
The IUPAC name of [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol (CID 11047886) is [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol.
What is the SMILES notation for [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol?
The canonical SMILES for [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol is CO[C@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C.
What is the InChIKey of [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol?
The InChIKey is VFMWHUHHZDIWSF-LJIZCISZSA-N. The full InChI is InChI=1S/C16H38O6Si3/c1-18-16-15(22-25(8,9)10)14(21-24(5,6)7)13(12(11-17)19-16)20-23(2,3)4/h12-17H,11H2,1-10H3/t12-,13-,14+,15-,16+/m1/s1.
What are the key properties of [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol?
[(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol has a molecular weight of 410.73 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R,4S,5R,6S)-6-methoxy-3,4,5-tris(trimethylsilyloxy)oxan-2-yl]methanol is sourced from PubChem (CID 11047886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).