tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane

C17H32O3Si2 — CID 152723809

IUPACtert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane
SMILESCO[Si](CCc1ccc([Si](C)(C)C(C)(C)C)cc1)(OC)OC
InChIInChI=1S/C17H32O3Si2/c1-17(2,3)21(7,8)16-11-9-15(10-12-16)13-14-22(18-4,19-5)20-6/h9-12H,13-14H2,1-8H3
InChIKeyZWEHUJQYDLOTIP-UHFFFAOYSA-N
MW340.61 g/mol
LogP3.82
Rot. Bonds7

About tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane

tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane (PubChem CID 152723809) has the molecular formula C17H32O3Si2 and a molecular weight of 340.61 g/mol. Its IUPAC name is tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane
PubChem CID152723809
Molecular FormulaC17H32O3Si2
Molecular Weight340.61 g/mol
Exact Mass340.19
IUPAC Nametert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane
SMILESCO[Si](CCc1ccc([Si](C)(C)C(C)(C)C)cc1)(OC)OC
InChIInChI=1S/C17H32O3Si2/c1-17(2,3)21(7,8)16-11-9-15(10-12-16)13-14-22(18-4,19-5)20-6/h9-12H,13-14H2,1-8H3
InChIKeyZWEHUJQYDLOTIP-UHFFFAOYSA-N
XLogP3.82
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.61
LogP ≤ 53.82
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

2-(4-tert-butylphenyl)ethyl-trimethoxysilane
CID 139668437
[bis(hydroxymethyl)-[2-[4-(2-trimethoxysilylethyl)phenyl]ethyl]silyl]methanol
CID 123655126
trimethoxy(2-phenylethyl)silane;trimethyl(2-phenylethyl)silane
CID 159040096
trimethoxy-[2-[4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)phenyl]ethyl]silane
CID 25261331
trimethoxy-[2-[3-(2-trimethoxysilylethyl)phenyl]ethyl]silane
CID 56847492
trimethoxy(2-phenylethyl)silane;trimethoxy(propyl)silane
CID 70127509
2-(3,4-dimethylphenyl)ethyl-trimethoxysilane
CID 59566689
8-hydroxyocta-3,5,7-triyn-2-one;trimethoxy-[2-[4-[2-[methoxy(dimethyl)silyl]ethyl]phenyl]ethyl]silane
CID 123741554
2-[4-(benzenesulfonylmethyl)phenyl]ethyl-trimethoxysilane
CID 90226834
scandium(3+);bis(trifluoromethanesulfonate);[4-(2-trimethoxysilylethyl)phenyl] sulfite
CID 134939750
2-(2,2-dimethyl-1,3-benzodioxol-5-yl)ethyl-trimethoxysilane
CID 170900368
2-(3,5-dimethoxyphenyl)ethyl-trimethoxysilane
CID 59566880

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane?
The IUPAC name of tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane (CID 152723809) is tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane.
What is the SMILES notation for tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane?
The canonical SMILES for tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane is CO[Si](CCc1ccc([Si](C)(C)C(C)(C)C)cc1)(OC)OC.
What is the InChIKey of tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane?
The InChIKey is ZWEHUJQYDLOTIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O3Si2/c1-17(2,3)21(7,8)16-11-9-15(10-12-16)13-14-22(18-4,19-5)20-6/h9-12H,13-14H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane?
tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane has a molecular weight of 340.61 g/mol, XLogP of 3.82, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[4-(2-trimethoxysilylethyl)phenyl]silane is sourced from PubChem (CID 152723809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).