[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane

C21H28O3Si — CID 173331093

IUPAC[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane
SMILESCC(C)(C)OC[C@@H]1CCC(O[SiH](c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C21H28O3Si/c1-21(2,3)22-16-17-14-15-20(23-17)24-25(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20,25H,14-16H2,1-3H3/t17-,20?/m0/s1
InChIKeySZKCOKAWRGMEDW-DIMJTDRSSA-N
MW356.54 g/mol
LogP2.86
Rot. Bonds6

About [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane

[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane (PubChem CID 173331093) has the molecular formula C21H28O3Si and a molecular weight of 356.54 g/mol. Its IUPAC name is [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane.

Molecular Properties

Compound Name[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane
PubChem CID173331093
Molecular FormulaC21H28O3Si
Molecular Weight356.54 g/mol
Exact Mass356.18
IUPAC Name[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane
SMILESCC(C)(C)OC[C@@H]1CCC(O[SiH](c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C21H28O3Si/c1-21(2,3)22-16-17-14-15-20(23-17)24-25(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20,25H,14-16H2,1-3H3/t17-,20?/m0/s1
InChIKeySZKCOKAWRGMEDW-DIMJTDRSSA-N
XLogP2.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.54
LogP ≤ 52.86
H-Bond Donors ≤ 50
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 [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane?
The IUPAC name of [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane (CID 173331093) is [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane.
What is the SMILES notation for [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane?
The canonical SMILES for [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane is CC(C)(C)OC[C@@H]1CCC(O[SiH](c2ccccc2)c2ccccc2)O1.
What is the InChIKey of [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane?
The InChIKey is SZKCOKAWRGMEDW-DIMJTDRSSA-N. The full InChI is InChI=1S/C21H28O3Si/c1-21(2,3)22-16-17-14-15-20(23-17)24-25(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-13,17,20,25H,14-16H2,1-3H3/t17-,20?/m0/s1.
What are the key properties of [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane?
[(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane has a molecular weight of 356.54 g/mol, XLogP of 2.86, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5S)-5-[(2-methylpropan-2-yl)oxymethyl]oxolan-2-yl]oxy-diphenylsilane is sourced from PubChem (CID 173331093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).