6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol

C23H32O3Si — CID 140747666

IUPAC6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol
SMILESCC(O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C1CCC(O)CO1
InChIInChI=1S/C23H32O3Si/c1-18(22-16-15-19(24)17-25-22)26-27(23(2,3)4,20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,18-19,22,24H,15-17H2,1-4H3
InChIKeyQZVPDENZRWXXON-UHFFFAOYSA-N
MW384.59 g/mol
LogP3.49
Rot. Bonds5

About 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol

6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol (PubChem CID 140747666) has the molecular formula C23H32O3Si and a molecular weight of 384.59 g/mol. Its IUPAC name is 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol.

Molecular Properties

Compound Name6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol
PubChem CID140747666
Molecular FormulaC23H32O3Si
Molecular Weight384.59 g/mol
Exact Mass384.21
IUPAC Name6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol
SMILESCC(O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C1CCC(O)CO1
InChIInChI=1S/C23H32O3Si/c1-18(22-16-15-19(24)17-25-22)26-27(23(2,3)4,20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,18-19,22,24H,15-17H2,1-4H3
InChIKeyQZVPDENZRWXXON-UHFFFAOYSA-N
XLogP3.49
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.59
LogP ≤ 53.49
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

tert-butyl-[(1S)-1-(2,4-dihydro-1H-3,1-benzoxazin-2-yl)ethoxy]-diphenylsilane
CID 10549907
tert-butyl-[(1S)-1-[(1S)-cyclohex-2-en-1-yl]ethoxy]-diphenylsilane
CID 57379185
(6-methyloxan-3-yl) (2R)-2-[tert-butyl(diphenyl)silyl]oxypropanoate
CID 175693360
tert-butyl-(3-oxabicyclo[3.2.1]octan-8-yloxy)-diphenylsilane
CID 171553746
(4S)-4-[tert-butyl(diphenyl)silyl]oxy-4-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]butan-2-ol
CID 132850699
3-[tert-butyl(diphenyl)silyl]oxycyclobutan-1-ol
CID 59414974
3-[1-[tert-butyl(diphenyl)silyl]oxyethyl]-2,2-dichlorocyclobutan-1-one
CID 66739441
tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
CID 11028852
(5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,4-dioxan-2-ol
CID 162409626
(3S)-3-[tert-butyl(diphenyl)silyl]oxypentane-1,4-diol
CID 15409689
(1S,2S,3R)-4-[tert-butyl(dimethyl)silyl]oxy-2-[tert-butyl(diphenyl)silyl]oxy-2-methyl-1-[(2R)-oxiran-2-yl]butane-1,3-diol
CID 10369738
tert-butyl-[(2R)-1-[(4S,5R)-4-methyl-1,3-oxazolidin-5-yl]propan-2-yl]oxy-diphenylsilane
CID 152696618

Frequently Asked Questions

What is the IUPAC name of 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol?
The IUPAC name of 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol (CID 140747666) is 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol.
What is the SMILES notation for 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol?
The canonical SMILES for 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol is CC(O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)C1CCC(O)CO1.
What is the InChIKey of 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol?
The InChIKey is QZVPDENZRWXXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32O3Si/c1-18(22-16-15-19(24)17-25-22)26-27(23(2,3)4,20-11-7-5-8-12-20)21-13-9-6-10-14-21/h5-14,18-19,22,24H,15-17H2,1-4H3.
What are the key properties of 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol?
6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol has a molecular weight of 384.59 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-[tert-butyl(diphenyl)silyl]oxyethyl]oxan-3-ol is sourced from PubChem (CID 140747666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).