[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol

C13H28O3Si — CID 102172703

IUPAC[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCC[C@@H]1CC[C@@H](CO)O1
InChIInChI=1S/C13H28O3Si/c1-13(2,3)17(4,5)15-9-8-11-6-7-12(10-14)16-11/h11-12,14H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKeyAFZPGUWOGIPOMF-RYUDHWBXSA-N
MW260.45 g/mol
LogP2.94
Rot. Bonds5

About [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol

[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol (PubChem CID 102172703) has the molecular formula C13H28O3Si and a molecular weight of 260.45 g/mol. Its IUPAC name is [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol
PubChem CID102172703
Molecular FormulaC13H28O3Si
Molecular Weight260.45 g/mol
Exact Mass260.18
IUPAC Name[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol
SMILESCC(C)(C)[Si](C)(C)OCC[C@@H]1CC[C@@H](CO)O1
InChIInChI=1S/C13H28O3Si/c1-13(2,3)17(4,5)15-9-8-11-6-7-12(10-14)16-11/h11-12,14H,6-10H2,1-5H3/t11-,12-/m0/s1
InChIKeyAFZPGUWOGIPOMF-RYUDHWBXSA-N
XLogP2.94
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol?
The IUPAC name of [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol (CID 102172703) is [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol.
What is the SMILES notation for [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol?
The canonical SMILES for [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol is CC(C)(C)[Si](C)(C)OCC[C@@H]1CC[C@@H](CO)O1.
What is the InChIKey of [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol?
The InChIKey is AFZPGUWOGIPOMF-RYUDHWBXSA-N. The full InChI is InChI=1S/C13H28O3Si/c1-13(2,3)17(4,5)15-9-8-11-6-7-12(10-14)16-11/h11-12,14H,6-10H2,1-5H3/t11-,12-/m0/s1.
What are the key properties of [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol?
[(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol has a molecular weight of 260.45 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5S)-5-[2-[tert-butyl(dimethyl)silyl]oxyethyl]oxolan-2-yl]methanol is sourced from PubChem (CID 102172703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).