2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol

C32H72O6Si4 — CID 140535876

IUPAC2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol
SMILESCC[Si](CC)(CC)OCC1OC(CCO)C(O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@@H]1O[Si](CC)(CC)CC
InChIInChI=1S/C32H72O6Si4/c1-13-39(14-2,15-3)34-27-29-31(37-41(19-7,20-8)21-9)32(38-42(22-10,23-11)24-12)30(28(35-29)25-26-33)36-40(16-4,17-5)18-6/h28-33H,13-27H2,1-12H3/t28?,29?,30?,31-,32-/m1/s1
InChIKeyGODFWIRCRVSGAD-LQJXKLSQSA-N
MW665.27 g/mol
LogP9.33
Rot. Bonds23

About 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol

2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol (PubChem CID 140535876) has the molecular formula C32H72O6Si4 and a molecular weight of 665.27 g/mol. Its IUPAC name is 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol.

Molecular Properties

Compound Name2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol
PubChem CID140535876
Molecular FormulaC32H72O6Si4
Molecular Weight665.27 g/mol
Exact Mass664.44
IUPAC Name2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol
SMILESCC[Si](CC)(CC)OCC1OC(CCO)C(O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@@H]1O[Si](CC)(CC)CC
InChIInChI=1S/C32H72O6Si4/c1-13-39(14-2,15-3)34-27-29-31(37-41(19-7,20-8)21-9)32(38-42(22-10,23-11)24-12)30(28(35-29)25-26-33)36-40(16-4,17-5)18-6/h28-33H,13-27H2,1-12H3/t28?,29?,30?,31-,32-/m1/s1
InChIKeyGODFWIRCRVSGAD-LQJXKLSQSA-N
XLogP9.33
TPSA66.38 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds23
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500665.27
LogP ≤ 59.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol?
The IUPAC name of 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol (CID 140535876) is 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol.
What is the SMILES notation for 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol?
The canonical SMILES for 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol is CC[Si](CC)(CC)OCC1OC(CCO)C(O[Si](CC)(CC)CC)[C@@H](O[Si](CC)(CC)CC)[C@@H]1O[Si](CC)(CC)CC.
What is the InChIKey of 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol?
The InChIKey is GODFWIRCRVSGAD-LQJXKLSQSA-N. The full InChI is InChI=1S/C32H72O6Si4/c1-13-39(14-2,15-3)34-27-29-31(37-41(19-7,20-8)21-9)32(38-42(22-10,23-11)24-12)30(28(35-29)25-26-33)36-40(16-4,17-5)18-6/h28-33H,13-27H2,1-12H3/t28?,29?,30?,31-,32-/m1/s1.
What are the key properties of 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol?
2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol has a molecular weight of 665.27 g/mol, XLogP of 9.33, 23 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R,5R)-3,4,5-tris(triethylsilyloxy)-6-(triethylsilyloxymethyl)oxan-2-yl]ethanol is sourced from PubChem (CID 140535876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).