ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane

C17H19F3O2Si — CID 91703876

IUPACethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane
SMILESCCO[Si](OC(C)C(F)(F)F)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19F3O2Si/c1-3-21-23(15-10-6-4-7-11-15,16-12-8-5-9-13-16)22-14(2)17(18,19)20/h4-14H,3H2,1-2H3
InChIKeyXEOHOUGTVAHXRX-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.25
Rot. Bonds6

About ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane

ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane (PubChem CID 91703876) has the molecular formula C17H19F3O2Si and a molecular weight of 340.42 g/mol. Its IUPAC name is ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane.

Molecular Properties

Compound Nameethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane
PubChem CID91703876
Molecular FormulaC17H19F3O2Si
Molecular Weight340.42 g/mol
Exact Mass340.11
IUPAC Nameethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane
SMILESCCO[Si](OC(C)C(F)(F)F)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19F3O2Si/c1-3-21-23(15-10-6-4-7-11-15,16-12-8-5-9-13-16)22-14(2)17(18,19)20/h4-14H,3H2,1-2H3
InChIKeyXEOHOUGTVAHXRX-UHFFFAOYSA-N
XLogP3.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane?
The IUPAC name of ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane (CID 91703876) is ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane.
What is the SMILES notation for ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane?
The canonical SMILES for ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane is CCO[Si](OC(C)C(F)(F)F)(c1ccccc1)c1ccccc1.
What is the InChIKey of ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane?
The InChIKey is XEOHOUGTVAHXRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19F3O2Si/c1-3-21-23(15-10-6-4-7-11-15,16-12-8-5-9-13-16)22-14(2)17(18,19)20/h4-14H,3H2,1-2H3.
What are the key properties of ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane?
ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane has a molecular weight of 340.42 g/mol, XLogP of 3.25, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-diphenyl-(1,1,1-trifluoropropan-2-yloxy)silane is sourced from PubChem (CID 91703876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).