tert-butyl-(2,4-difluorophenoxy)-dimethylsilane

C12H18F2OSi — CID 14811687

IUPACtert-butyl-(2,4-difluorophenoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(F)cc1F
InChIInChI=1S/C12H18F2OSi/c1-12(2,3)16(4,5)15-11-7-6-9(13)8-10(11)14/h6-8H,1-5H3
InChIKeyVPJRYEAISBQZCM-UHFFFAOYSA-N
MW244.36 g/mol
LogP4.35
Rot. Bonds2

About tert-butyl-(2,4-difluorophenoxy)-dimethylsilane

tert-butyl-(2,4-difluorophenoxy)-dimethylsilane (PubChem CID 14811687) has the molecular formula C12H18F2OSi and a molecular weight of 244.36 g/mol. Its IUPAC name is tert-butyl-(2,4-difluorophenoxy)-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(2,4-difluorophenoxy)-dimethylsilane
PubChem CID14811687
Molecular FormulaC12H18F2OSi
Molecular Weight244.36 g/mol
Exact Mass244.11
IUPAC Nametert-butyl-(2,4-difluorophenoxy)-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(F)cc1F
InChIInChI=1S/C12H18F2OSi/c1-12(2,3)16(4,5)15-11-7-6-9(13)8-10(11)14/h6-8H,1-5H3
InChIKeyVPJRYEAISBQZCM-UHFFFAOYSA-N
XLogP4.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[2-[tert-butyl(dimethyl)silyl]oxy-5-fluorophenyl]boronic acid
CID 167729414
tert-butyl-dimethyl-(2,3,4-trifluorophenoxy)silane
CID 91697441
tert-butyl-dimethyl-[4,5,8-tris[[tert-butyl(dimethyl)silyl]oxy]naphthalen-1-yl]oxysilane
CID 10604266
3-[tert-butyl(dimethyl)silyl]oxy-4-fluoroaniline
CID 167728842
3-[tert-butyl(dimethyl)silyl]oxy-4-fluorobenzonitrile
CID 167718613
2-(2,4-difluorophenoxy)-2-methylpropanenitrile
CID 57467467
tert-butyl-(5-chloro-2-methoxyphenoxy)-dimethylsilane
CID 125116719
tert-butyl-(2-fluoro-5-nitrophenoxy)-dimethylsilane
CID 125116243
2-[tert-butyl(dimethyl)silyl]oxyphenol
CID 10878826
4-[tert-butyl(dimethyl)silyl]oxy-3-(trifluoromethyl)aniline
CID 167742653
[3-[tert-butyl(dimethyl)silyl]oxy-2-fluorophenyl]boronic acid
CID 53216501
(2-bromo-3-fluoro-5-methoxyphenoxy)-tert-butyl-dimethylsilane
CID 167724287

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(2,4-difluorophenoxy)-dimethylsilane?
The IUPAC name of tert-butyl-(2,4-difluorophenoxy)-dimethylsilane (CID 14811687) is tert-butyl-(2,4-difluorophenoxy)-dimethylsilane.
What is the SMILES notation for tert-butyl-(2,4-difluorophenoxy)-dimethylsilane?
The canonical SMILES for tert-butyl-(2,4-difluorophenoxy)-dimethylsilane is CC(C)(C)[Si](C)(C)Oc1ccc(F)cc1F.
What is the InChIKey of tert-butyl-(2,4-difluorophenoxy)-dimethylsilane?
The InChIKey is VPJRYEAISBQZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18F2OSi/c1-12(2,3)16(4,5)15-11-7-6-9(13)8-10(11)14/h6-8H,1-5H3.
What are the key properties of tert-butyl-(2,4-difluorophenoxy)-dimethylsilane?
tert-butyl-(2,4-difluorophenoxy)-dimethylsilane has a molecular weight of 244.36 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2,4-difluorophenoxy)-dimethylsilane is sourced from PubChem (CID 14811687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).