diethoxy-methyl-(trifluoromethyl)silane

C6H13F3O2Si — CID 54011031

IUPACdiethoxy-methyl-(trifluoromethyl)silane
SMILESCCO[Si](C)(OCC)C(F)(F)F
InChIInChI=1S/C6H13F3O2Si/c1-4-10-12(3,11-5-2)6(7,8)9/h4-5H2,1-3H3
InChIKeyKSJACIJGCBTKAT-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.23
Rot. Bonds4

About diethoxy-methyl-(trifluoromethyl)silane

diethoxy-methyl-(trifluoromethyl)silane (PubChem CID 54011031) has the molecular formula C6H13F3O2Si and a molecular weight of 202.25 g/mol. Its IUPAC name is diethoxy-methyl-(trifluoromethyl)silane.

Molecular Properties

Compound Namediethoxy-methyl-(trifluoromethyl)silane
PubChem CID54011031
Molecular FormulaC6H13F3O2Si
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC Namediethoxy-methyl-(trifluoromethyl)silane
SMILESCCO[Si](C)(OCC)C(F)(F)F
InChIInChI=1S/C6H13F3O2Si/c1-4-10-12(3,11-5-2)6(7,8)9/h4-5H2,1-3H3
InChIKeyKSJACIJGCBTKAT-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.23
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 diethoxy-methyl-(trifluoromethyl)silane?
The IUPAC name of diethoxy-methyl-(trifluoromethyl)silane (CID 54011031) is diethoxy-methyl-(trifluoromethyl)silane.
What is the SMILES notation for diethoxy-methyl-(trifluoromethyl)silane?
The canonical SMILES for diethoxy-methyl-(trifluoromethyl)silane is CCO[Si](C)(OCC)C(F)(F)F.
What is the InChIKey of diethoxy-methyl-(trifluoromethyl)silane?
The InChIKey is KSJACIJGCBTKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13F3O2Si/c1-4-10-12(3,11-5-2)6(7,8)9/h4-5H2,1-3H3.
What are the key properties of diethoxy-methyl-(trifluoromethyl)silane?
diethoxy-methyl-(trifluoromethyl)silane has a molecular weight of 202.25 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-(trifluoromethyl)silane is sourced from PubChem (CID 54011031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).