dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane

C12H15F5OSi — CID 523443

IUPACdimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCC(C)CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C12H15F5OSi/c1-6(2)5-18-19(3,4)12-10(16)8(14)7(13)9(15)11(12)17/h6H,5H2,1-4H3
InChIKeyUXHWWUWXTZKTRA-UHFFFAOYSA-N
MW298.33 g/mol
LogP3.47
Rot. Bonds4

About dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane

dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 523443) has the molecular formula C12H15F5OSi and a molecular weight of 298.33 g/mol. Its IUPAC name is dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namedimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID523443
Molecular FormulaC12H15F5OSi
Molecular Weight298.33 g/mol
Exact Mass298.08
IUPAC Namedimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCC(C)CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C12H15F5OSi/c1-6(2)5-18-19(3,4)12-10(16)8(14)7(13)9(15)11(12)17/h6H,5H2,1-4H3
InChIKeyUXHWWUWXTZKTRA-UHFFFAOYSA-N
XLogP3.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.33
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(Triethoxysilyl)pentafluorobenzene
CID 2782625
Trimethoxy(pentafluorophenyl)silane
CID 2782640
1-Dimethyl(pentafluorophenyl)silyloxypropane
CID 523425
Pentafluorophenylethoxydimethylsilane
CID 523441
Silane, methoxydimethyl(pentafluorophenyl)-
CID 523444
Bis(pentafluorophenyl)diethoxysilane
CID 11102434
Pentafluorophenyl(vinyl)dimethoxysilane
CID 22389966
Ethenyl(diethoxy)(pentafluorophenyl)silane
CID 23523559
Dimethyl(t-butyl)-(pentafluorophenyl)silane
CID 85922422
1-Dimethyl(pentafluorophenyl)silyloxybutane
CID 523424
2-Dimethyl(pentafluorophenyl)silyloxybutane
CID 523426
2-Dimethyl(pentafluorophenyl)silyloxypropane
CID 523428

Frequently Asked Questions

What is the IUPAC name of dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane (CID 523443) is dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane is CC(C)CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is UXHWWUWXTZKTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F5OSi/c1-6(2)5-18-19(3,4)12-10(16)8(14)7(13)9(15)11(12)17/h6H,5H2,1-4H3.
What are the key properties of dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane?
dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 298.33 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(2-methylpropoxy)-(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 523443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).