trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane

C13H19F3O2Si — CID 177342967

IUPACtrimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCOc1ccccc1C(F)(F)F
InChIInChI=1S/C13H19F3O2Si/c1-19(2,3)9-8-17-10-18-12-7-5-4-6-11(12)13(14,15)16/h4-7H,8-10H2,1-3H3
InChIKeyNRXMAABPKISDLP-UHFFFAOYSA-N
MW292.37 g/mol
LogP4.40
Rot. Bonds6

About trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane

trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane (PubChem CID 177342967) has the molecular formula C13H19F3O2Si and a molecular weight of 292.37 g/mol. Its IUPAC name is trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane
PubChem CID177342967
Molecular FormulaC13H19F3O2Si
Molecular Weight292.37 g/mol
Exact Mass292.11
IUPAC Nametrimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane
SMILESC[Si](C)(C)CCOCOc1ccccc1C(F)(F)F
InChIInChI=1S/C13H19F3O2Si/c1-19(2,3)9-8-17-10-18-12-7-5-4-6-11(12)13(14,15)16/h4-7H,8-10H2,1-3H3
InChIKeyNRXMAABPKISDLP-UHFFFAOYSA-N
XLogP4.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.37
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane?
The IUPAC name of trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane (CID 177342967) is trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane.
What is the SMILES notation for trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane?
The canonical SMILES for trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane is C[Si](C)(C)CCOCOc1ccccc1C(F)(F)F.
What is the InChIKey of trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane?
The InChIKey is NRXMAABPKISDLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19F3O2Si/c1-19(2,3)9-8-17-10-18-12-7-5-4-6-11(12)13(14,15)16/h4-7H,8-10H2,1-3H3.
What are the key properties of trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane?
trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane has a molecular weight of 292.37 g/mol, XLogP of 4.40, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[[2-(trifluoromethyl)phenoxy]methoxy]ethyl]silane is sourced from PubChem (CID 177342967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).