tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane

C17H29FOSi — CID 22975271

IUPACtert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane
SMILESCC(C)(C)c1ccc(F)cc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H29FOSi/c1-16(2,3)15-10-9-14(18)11-13(15)12-19-20(7,8)17(4,5)6/h9-11H,12H2,1-8H3
InChIKeyHKBZVAFXQPBGMZ-UHFFFAOYSA-N
MW296.50 g/mol
LogP5.64
Rot. Bonds3

About tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane

tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane (PubChem CID 22975271) has the molecular formula C17H29FOSi and a molecular weight of 296.50 g/mol. Its IUPAC name is tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane
PubChem CID22975271
Molecular FormulaC17H29FOSi
Molecular Weight296.50 g/mol
Exact Mass296.20
IUPAC Nametert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane
SMILESCC(C)(C)c1ccc(F)cc1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H29FOSi/c1-16(2,3)15-10-9-14(18)11-13(15)12-19-20(7,8)17(4,5)6/h9-11H,12H2,1-8H3
InChIKeyHKBZVAFXQPBGMZ-UHFFFAOYSA-N
XLogP5.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.50
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Benzyloxytrimethylsilane
CID 518982
Silane, triethyl(phenylmethoxy)-
CID 563229
((1-(2-Fluorophenyl)vinyl)oxy)trimethylsilane
CID 10954822
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, trimethyl(1-phenylethoxy)-
CID 519015
1-Propanol, 1-phenyl, TMS
CID 530376
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
2-Fluorobenzyl alcohol, tert-butyldimethylsilyl ether
CID 91728155
2-(Trimethylsilylmethyl)benzyl alcohol
CID 3850342
Silane, [[1-(4-fluorophenyl)ethenyl]oxy]trimethyl-
CID 10398215
Fluoro-[[fluoro(dimethyl)silyl]oxy-phenylmethyl]-dimethylsilane
CID 86186484

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane (CID 22975271) is tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane is CC(C)(C)c1ccc(F)cc1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane?
The InChIKey is HKBZVAFXQPBGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29FOSi/c1-16(2,3)15-10-9-14(18)11-13(15)12-19-20(7,8)17(4,5)6/h9-11H,12H2,1-8H3.
What are the key properties of tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane?
tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane has a molecular weight of 296.50 g/mol, XLogP of 5.64, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2-tert-butyl-5-fluorophenyl)methoxy]-dimethylsilane is sourced from PubChem (CID 22975271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).