oxolane;tetramethylazanium;fluoride

C8H20FNO — CID 157366963

IUPACoxolane;tetramethylazanium;fluoride
SMILESC1CCOC1.C[N+](C)(C)C.[F-]
InChIInChI=1S/C4H12N.C4H8O.FH/c1-5(2,3)4;1-2-4-5-3-1;/h1-4H3;1-4H2;1H/q+1;;/p-1
InChIKeyBJHLMMFPYWPVPV-UHFFFAOYSA-M
MW165.25 g/mol
LogP-1.88
Rot. Bonds

About oxolane;tetramethylazanium;fluoride

oxolane;tetramethylazanium;fluoride (PubChem CID 157366963) has the molecular formula C8H20FNO and a molecular weight of 165.25 g/mol. Its IUPAC name is oxolane;tetramethylazanium;fluoride.

Molecular Properties

Compound Nameoxolane;tetramethylazanium;fluoride
PubChem CID157366963
Molecular FormulaC8H20FNO
Molecular Weight165.25 g/mol
Exact Mass165.15
IUPAC Nameoxolane;tetramethylazanium;fluoride
SMILESC1CCOC1.C[N+](C)(C)C.[F-]
InChIInChI=1S/C4H12N.C4H8O.FH/c1-5(2,3)4;1-2-4-5-3-1;/h1-4H3;1-4H2;1H/q+1;;/p-1
InChIKeyBJHLMMFPYWPVPV-UHFFFAOYSA-M
XLogP-1.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.25
LogP ≤ 5-1.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxolane;tetramethylazanium;fluoride?
The IUPAC name of oxolane;tetramethylazanium;fluoride (CID 157366963) is oxolane;tetramethylazanium;fluoride.
What is the SMILES notation for oxolane;tetramethylazanium;fluoride?
The canonical SMILES for oxolane;tetramethylazanium;fluoride is C1CCOC1.C[N+](C)(C)C.[F-].
What is the InChIKey of oxolane;tetramethylazanium;fluoride?
The InChIKey is BJHLMMFPYWPVPV-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H12N.C4H8O.FH/c1-5(2,3)4;1-2-4-5-3-1;/h1-4H3;1-4H2;1H/q+1;;/p-1.
What are the key properties of oxolane;tetramethylazanium;fluoride?
oxolane;tetramethylazanium;fluoride has a molecular weight of 165.25 g/mol, XLogP of -1.88, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for oxolane;tetramethylazanium;fluoride is sourced from PubChem (CID 157366963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).