dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane

C17H19F3OSi — CID 142748813

IUPACdimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane
SMILESCC(O[Si](C)(C)c1ccccc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H19F3OSi/c1-13(14-9-11-15(12-10-14)17(18,19)20)21-22(2,3)16-7-5-4-6-8-16/h4-13H,1-3H3
InChIKeyISXJCPCIMZMFGJ-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.90
Rot. Bonds4

About dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane

dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane (PubChem CID 142748813) has the molecular formula C17H19F3OSi and a molecular weight of 324.42 g/mol. Its IUPAC name is dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane.

Molecular Properties

Compound Namedimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane
PubChem CID142748813
Molecular FormulaC17H19F3OSi
Molecular Weight324.42 g/mol
Exact Mass324.12
IUPAC Namedimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane
SMILESCC(O[Si](C)(C)c1ccccc1)c1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H19F3OSi/c1-13(14-9-11-15(12-10-14)17(18,19)20)21-22(2,3)16-7-5-4-6-8-16/h4-13H,1-3H3
InChIKeyISXJCPCIMZMFGJ-UHFFFAOYSA-N
XLogP4.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.90
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

4-(Trifluoromethyl)benzhydrol
CID 258897
2-[4-[Benzyl(dimethyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168281096
2-[4-[Dimethyl(phenyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168285849
(4-Methylphenyl)[4-(trifluoromethyl)phenyl]methanol
CID 5109986
2,2,2-Trifluoro-1-phenylethyl trimethylsilyl ether
CID 11218868
Silane, trimethyl(1-phenylethoxy)-
CID 519015
1-Propanol, 1-phenyl, TMS
CID 530376
Trimethyl[(4-methylphenyl)methoxy]silane
CID 13063937
4-Methylbenzyl alcohol, tert-butyldimethylsilyl ether
CID 21304531
Dimethyl(diphenylmethoxy)(pentafluorophenyl)silane
CID 4581060
4-(Trimethylsilyl)benzhydrol
CID 3551384
1-[4-[4-(Trifluoromethyl)phenyl]phenyl]hexane-1,6-diol
CID 49866192

Frequently Asked Questions

What is the IUPAC name of dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane?
The IUPAC name of dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane (CID 142748813) is dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane.
What is the SMILES notation for dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane?
The canonical SMILES for dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane is CC(O[Si](C)(C)c1ccccc1)c1ccc(C(F)(F)F)cc1.
What is the InChIKey of dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane?
The InChIKey is ISXJCPCIMZMFGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3OSi/c1-13(14-9-11-15(12-10-14)17(18,19)20)21-22(2,3)16-7-5-4-6-8-16/h4-13H,1-3H3.
What are the key properties of dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane?
dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane has a molecular weight of 324.42 g/mol, XLogP of 4.90, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-phenyl-[1-[4-(trifluoromethyl)phenyl]ethoxy]silane is sourced from PubChem (CID 142748813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).