tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane

C15H21F3O2Si — CID 135012556

IUPACtert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane
SMILESCC(C)(C)[Si](C)(C)O/C(=C\OC(F)(F)F)c1ccccc1
InChIInChI=1S/C15H21F3O2Si/c1-14(2,3)21(4,5)20-13(11-19-15(16,17)18)12-9-7-6-8-10-12/h6-11H,1-5H3/b13-11-
InChIKeyTVYPAMHMZOMYPF-QBFSEMIESA-N
MW318.41 g/mol
LogP5.54
Rot. Bonds4

About tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane

tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane (PubChem CID 135012556) has the molecular formula C15H21F3O2Si and a molecular weight of 318.41 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane
PubChem CID135012556
Molecular FormulaC15H21F3O2Si
Molecular Weight318.41 g/mol
Exact Mass318.13
IUPAC Nametert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane
SMILESCC(C)(C)[Si](C)(C)O/C(=C\OC(F)(F)F)c1ccccc1
InChIInChI=1S/C15H21F3O2Si/c1-14(2,3)21(4,5)20-13(11-19-15(16,17)18)12-9-7-6-8-10-12/h6-11H,1-5H3/b13-11-
InChIKeyTVYPAMHMZOMYPF-QBFSEMIESA-N
XLogP5.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500318.41
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(Z)-1-phenylprop-1-enoxy]silane
CID 10377349
tert-butyl-[(Z)-1,2-diphenylethenoxy]-dimethylsilane
CID 10358065
tert-butyl-dimethyl-(2-methyl-1-phenylprop-1-enoxy)silane
CID 11391374
tert-butyl-[(1Z)-3,7-dimethyl-1-phenylocta-1,6-dienoxy]-dimethylsilane
CID 14710921
tert-butyl-dimethyl-[(E)-3-phenylbut-2-en-2-yl]oxysilane
CID 100917085
tert-butyl-dimethyl-(1-naphthalen-2-ylprop-1-enoxy)silane
CID 67471172
tert-butyl-dimethyl-[1-(3-methylphenyl)prop-1-enoxy]silane
CID 75217044
ethyl (E)-5-[tert-butyl(dimethyl)silyl]oxy-3-methyl-5-phenylpent-4-enoate
CID 102331027
tert-butyl-dimethyl-[(1Z,3Z)-4-(4-nitrophenyl)-1-phenylbuta-1,3-dienoxy]silane
CID 102342625
tert-butyl-[1-(3-methoxyphenyl)prop-1-enoxy]-dimethylsilane
CID 67470985
diethyl 2-[(Z)-3-[tert-butyl(dimethyl)silyl]oxy-3-phenylprop-2-enyl]-2-ethynylpropanedioate
CID 101002395
2-[tert-butyl(dimethyl)silyl]oxy-3-phenylprop-2-enal
CID 175337315

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane (CID 135012556) is tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane is CC(C)(C)[Si](C)(C)O/C(=C\OC(F)(F)F)c1ccccc1.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane?
The InChIKey is TVYPAMHMZOMYPF-QBFSEMIESA-N. The full InChI is InChI=1S/C15H21F3O2Si/c1-14(2,3)21(4,5)20-13(11-19-15(16,17)18)12-9-7-6-8-10-12/h6-11H,1-5H3/b13-11-.
What are the key properties of tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane?
tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane has a molecular weight of 318.41 g/mol, XLogP of 5.54, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-1-phenyl-2-(trifluoromethoxy)ethenoxy]silane is sourced from PubChem (CID 135012556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).