3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol

C15H32O3Si — CID 54175371

IUPAC3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1CCC[C@H](CCCO)O1
InChIInChI=1S/C15H32O3Si/c1-15(2,3)19(4,5)17-12-14-9-6-8-13(18-14)10-7-11-16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1
InChIKeyOXYGSBGGABWFMS-ZIAGYGMSSA-N
MW288.50 g/mol
LogP3.72
Rot. Bonds6

About 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol

3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol (PubChem CID 54175371) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol
PubChem CID54175371
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Name3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol
SMILESCC(C)(C)[Si](C)(C)OC[C@H]1CCC[C@H](CCCO)O1
InChIInChI=1S/C15H32O3Si/c1-15(2,3)19(4,5)17-12-14-9-6-8-13(18-14)10-7-11-16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1
InChIKeyOXYGSBGGABWFMS-ZIAGYGMSSA-N
XLogP3.72
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 53.72
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

2-[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]ethanol
CID 10706494
[(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]methanol
CID 10890219
[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]methanol
CID 11322576
3-[[(2R,3R)-3-[tert-butyl(dimethyl)silyl]oxyoxan-2-yl]methoxy]propan-1-ol
CID 44438951
(R)-1-((tert-Butyldimethylsilyl)oxy)-3-(octadecyloxy)propan-2-ol
CID 10790085
(2S)-4-[tert-butyl(dimethyl)silyl]oxy-1-hexadecoxybutan-2-ol
CID 11362793
(4R)-4-[tert-butyl(dimethyl)silyl]oxynonan-1-ol
CID 54576111
(2R,3S)-2-{[(tert-butyldimethylsilyl)oxy]methyl}oxan-3-ol
CID 15785525
(2R,3S,6S)-2-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-6-methyloxan-3-ol
CID 10492591
(4S,5R)-4-[(1R)-1-[tert-butyl(dimethyl)silyl]oxypentadecyl]-2,2-dimethyl-1,3-dioxan-5-ol
CID 25022950
(2R,4R)-4-[tert-butyl(dimethyl)silyl]oxynonane-1,2-diol
CID 54576109
(2S)-1-[tert-butyl(dimethyl)silyl]oxynonan-2-ol
CID 102143599

Frequently Asked Questions

What is the IUPAC name of 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol?
The IUPAC name of 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol (CID 54175371) is 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol.
What is the SMILES notation for 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol?
The canonical SMILES for 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol is CC(C)(C)[Si](C)(C)OC[C@H]1CCC[C@H](CCCO)O1.
What is the InChIKey of 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol?
The InChIKey is OXYGSBGGABWFMS-ZIAGYGMSSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-15(2,3)19(4,5)17-12-14-9-6-8-13(18-14)10-7-11-16/h13-14,16H,6-12H2,1-5H3/t13-,14-/m1/s1.
What are the key properties of 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol?
3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol has a molecular weight of 288.50 g/mol, XLogP of 3.72, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]oxan-2-yl]propan-1-ol is sourced from PubChem (CID 54175371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).