tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane

C17H30O3Si — CID 141377156

IUPACtert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane
SMILESCc1cccc(OCCOCCO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C17H30O3Si/c1-15-8-7-9-16(14-15)19-12-10-18-11-13-20-21(5,6)17(2,3)4/h7-9,14H,10-13H2,1-6H3
InChIKeyPJKSOAPILQQFDI-UHFFFAOYSA-N
MW310.51 g/mol
LogP4.41
Rot. Bonds8

About tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane

tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane (PubChem CID 141377156) has the molecular formula C17H30O3Si and a molecular weight of 310.51 g/mol. Its IUPAC name is tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane
PubChem CID141377156
Molecular FormulaC17H30O3Si
Molecular Weight310.51 g/mol
Exact Mass310.20
IUPAC Nametert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane
SMILESCc1cccc(OCCOCCO[Si](C)(C)C(C)(C)C)c1
InChIInChI=1S/C17H30O3Si/c1-15-8-7-9-16(14-15)19-12-10-18-11-13-20-21(5,6)17(2,3)4/h7-9,14H,10-13H2,1-6H3
InChIKeyPJKSOAPILQQFDI-UHFFFAOYSA-N
XLogP4.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.51
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[2-[2-[2-[2-(4-ethynylphenoxy)ethoxy]ethoxy]ethoxy]ethoxy]-dimethylsilane
CID 58324093
4-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-2-methylaniline
CID 69452895
1-methyl-3-[4-(3-methylphenoxy)butoxy]benzene
CID 2237989
N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-3-methylaniline
CID 144516245
N-ethyl-2-[2-(3-methylphenoxy)ethoxy]ethanamine
CID 82353109
1-methyl-3-[6-(3-methylphenoxy)hexoxy]benzene
CID 2304788
tert-butyl-[2-[2-(4-fluoro-3-nitrophenoxy)ethoxy]ethoxy]-dimethylsilane
CID 178155414
4-[2-[4-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]phenyl]ethynyl]aniline
CID 16659289
1-methoxy-4-[2-(3-methylphenoxy)ethoxy]benzene
CID 14047829
tert-butyl-dimethyl-[2-(4-methyl-3-nitrophenoxy)ethoxy]silane
CID 69453503
[4-[2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]phenyl]-(4-chlorophenyl)methanone
CID 164811325
1-[5-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]-2-nitrophenyl]prop-2-en-1-one
CID 54251521

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane (CID 141377156) is tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane is Cc1cccc(OCCOCCO[Si](C)(C)C(C)(C)C)c1.
What is the InChIKey of tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane?
The InChIKey is PJKSOAPILQQFDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O3Si/c1-15-8-7-9-16(14-15)19-12-10-18-11-13-20-21(5,6)17(2,3)4/h7-9,14H,10-13H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane?
tert-butyl-dimethyl-[2-[2-(3-methylphenoxy)ethoxy]ethoxy]silane has a molecular weight of 310.51 g/mol, XLogP of 4.41, 8 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-(3-methylphenoxy)ethoxy]ethoxy]silane is sourced from PubChem (CID 141377156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).