tetramethylazanium;trifluoromethaneselenolate

C5H12F3NSe — CID 11241514

IUPACtetramethylazanium;trifluoromethaneselenolate
SMILESC[N+](C)(C)C.FC(F)(F)[Se-]
InChIInChI=1S/C4H12N.CHF3Se/c1-5(2,3)4;2-1(3,4)5/h1-4H3;5H/q+1;/p-1
InChIKeyVCNHJXSZCJQXPA-UHFFFAOYSA-M
MW222.11 g/mol
LogP1.00
Rot. Bonds

About tetramethylazanium;trifluoromethaneselenolate

tetramethylazanium;trifluoromethaneselenolate (PubChem CID 11241514) has the molecular formula C5H12F3NSe and a molecular weight of 222.11 g/mol. Its IUPAC name is tetramethylazanium;trifluoromethaneselenolate.

Molecular Properties

Compound Nametetramethylazanium;trifluoromethaneselenolate
PubChem CID11241514
Molecular FormulaC5H12F3NSe
Molecular Weight222.11 g/mol
Exact Mass223.01
IUPAC Nametetramethylazanium;trifluoromethaneselenolate
SMILESC[N+](C)(C)C.FC(F)(F)[Se-]
InChIInChI=1S/C4H12N.CHF3Se/c1-5(2,3)4;2-1(3,4)5/h1-4H3;5H/q+1;/p-1
InChIKeyVCNHJXSZCJQXPA-UHFFFAOYSA-M
XLogP1.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.11
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tetramethylazanium;trifluoromethaneselenolate?
The IUPAC name of tetramethylazanium;trifluoromethaneselenolate (CID 11241514) is tetramethylazanium;trifluoromethaneselenolate.
What is the SMILES notation for tetramethylazanium;trifluoromethaneselenolate?
The canonical SMILES for tetramethylazanium;trifluoromethaneselenolate is C[N+](C)(C)C.FC(F)(F)[Se-].
What is the InChIKey of tetramethylazanium;trifluoromethaneselenolate?
The InChIKey is VCNHJXSZCJQXPA-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H12N.CHF3Se/c1-5(2,3)4;2-1(3,4)5/h1-4H3;5H/q+1;/p-1.
What are the key properties of tetramethylazanium;trifluoromethaneselenolate?
tetramethylazanium;trifluoromethaneselenolate has a molecular weight of 222.11 g/mol, XLogP of 1.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetramethylazanium;trifluoromethaneselenolate is sourced from PubChem (CID 11241514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).