4-(2-fluoroethylimino)oxolan-2-one

C6H8FNO2 — CID 91395027

IUPAC4-(2-fluoroethylimino)oxolan-2-one
SMILESO=C1C/C(=N/CCF)CO1
InChIInChI=1S/C6H8FNO2/c7-1-2-8-5-3-6(9)10-4-5/h1-4H2/b8-5-
InChIKeyVTRZBXSUCGZULV-YVMONPNESA-N
MW145.13 g/mol
LogP0.34
Rot. Bonds2

About 4-(2-fluoroethylimino)oxolan-2-one

4-(2-fluoroethylimino)oxolan-2-one (PubChem CID 91395027) has the molecular formula C6H8FNO2 and a molecular weight of 145.13 g/mol. Its IUPAC name is 4-(2-fluoroethylimino)oxolan-2-one.

Molecular Properties

Compound Name4-(2-fluoroethylimino)oxolan-2-one
PubChem CID91395027
Molecular FormulaC6H8FNO2
Molecular Weight145.13 g/mol
Exact Mass145.05
IUPAC Name4-(2-fluoroethylimino)oxolan-2-one
SMILESO=C1C/C(=N/CCF)CO1
InChIInChI=1S/C6H8FNO2/c7-1-2-8-5-3-6(9)10-4-5/h1-4H2/b8-5-
InChIKeyVTRZBXSUCGZULV-YVMONPNESA-N
XLogP0.34
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.13
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-ethyl-2-(trifluoromethyl)-2H-1,3-oxazol-5-one
CID 102120437
4-(2,2-Difluoroethylimino)oxolan-2-one
CID 91053419
4-Methyliminooxolan-2-one
CID 57316605
4-Butyliminooxolan-2-one
CID 90970183
4-Propyliminooxolan-2-one
CID 91052829
4-(2-Methylpropylimino)oxolan-2-one
CID 91144067
4-Cyclopropyliminooxolan-2-one
CID 91233183
4-Ethyliminooxolan-2-one
CID 91255105
3-Methyliminooxolan-2-one
CID 140357637

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroethylimino)oxolan-2-one?
The IUPAC name of 4-(2-fluoroethylimino)oxolan-2-one (CID 91395027) is 4-(2-fluoroethylimino)oxolan-2-one.
What is the SMILES notation for 4-(2-fluoroethylimino)oxolan-2-one?
The canonical SMILES for 4-(2-fluoroethylimino)oxolan-2-one is O=C1C/C(=N/CCF)CO1.
What is the InChIKey of 4-(2-fluoroethylimino)oxolan-2-one?
The InChIKey is VTRZBXSUCGZULV-YVMONPNESA-N. The full InChI is InChI=1S/C6H8FNO2/c7-1-2-8-5-3-6(9)10-4-5/h1-4H2/b8-5-.
What are the key properties of 4-(2-fluoroethylimino)oxolan-2-one?
4-(2-fluoroethylimino)oxolan-2-one has a molecular weight of 145.13 g/mol, XLogP of 0.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroethylimino)oxolan-2-one is sourced from PubChem (CID 91395027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).