tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane

C18H27NO2Si — CID 10852985

IUPACtert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCc1coc(CCc2ccccc2)n1
InChIInChI=1S/C18H27NO2Si/c1-18(2,3)22(4,5)21-14-16-13-20-17(19-16)12-11-15-9-7-6-8-10-15/h6-10,13H,11-12,14H2,1-5H3
InChIKeyZSQSTHPVDUGYOS-UHFFFAOYSA-N
MW317.50 g/mol
LogP4.98
Rot. Bonds6

About tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane

tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane (PubChem CID 10852985) has the molecular formula C18H27NO2Si and a molecular weight of 317.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane
PubChem CID10852985
Molecular FormulaC18H27NO2Si
Molecular Weight317.50 g/mol
Exact Mass317.18
IUPAC Nametert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCc1coc(CCc2ccccc2)n1
InChIInChI=1S/C18H27NO2Si/c1-18(2,3)22(4,5)21-14-16-13-20-17(19-16)12-11-15-9-7-6-8-10-15/h6-10,13H,11-12,14H2,1-5H3
InChIKeyZSQSTHPVDUGYOS-UHFFFAOYSA-N
XLogP4.98
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.50
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-(2-phenylethoxy)silane
CID 11128311
1-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]-N-(2-phenylethyl)ethanamine
CID 69157669
2-[3-[2-[6-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-pyridinyl]ethyl]phenyl]ethanamine
CID 69157839
[3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methanamine
CID 22049979
tert-butyl-(deuteriomethyl)-methyl-phenylmethoxysilane
CID 11075026
2-benzyl-6-[[tert-butyl(dimethyl)silyl]oxymethyl]pyridin-3-ol
CID 18182288
tert-butyl-dimethyl-(quinolin-2-ylmethoxy)silane
CID 54324291
(3-benzylimidazol-4-yl)methoxy-tert-butyl-dimethylsilane
CID 14410060
tert-butyl-[(2R,3R)-2,3-dichloro-5-phenylpentoxy]-dimethylsilane
CID 86287443
1-[[2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-oxazol-4-yl]methyl]pyrazol-4-amine
CID 66928495
3-[[tert-butyl(dimethyl)silyl]oxymethyl]phenol
CID 14940556
tert-butyl-dimethyl-[(3-methylphenyl)methoxy]silane
CID 22967275

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane (CID 10852985) is tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane is CC(C)(C)[Si](C)(C)OCc1coc(CCc2ccccc2)n1.
What is the InChIKey of tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane?
The InChIKey is ZSQSTHPVDUGYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO2Si/c1-18(2,3)22(4,5)21-14-16-13-20-17(19-16)12-11-15-9-7-6-8-10-15/h6-10,13H,11-12,14H2,1-5H3.
What are the key properties of tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane?
tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane has a molecular weight of 317.50 g/mol, XLogP of 4.98, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[2-(2-phenylethyl)-1,3-oxazol-4-yl]methoxy]silane is sourced from PubChem (CID 10852985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).