1-ethenoxy-1-fluoroethene

C4H5FO — CID 23500967

IUPAC1-ethenoxy-1-fluoroethene
SMILESC=COC(=C)F
InChIInChI=1S/C4H5FO/c1-3-6-4(2)5/h3H,1-2H2
InChIKeyOWHPGRQGKQRWIM-UHFFFAOYSA-N
MW88.08 g/mol
LogP1.59
Rot. Bonds2

About 1-ethenoxy-1-fluoroethene

1-ethenoxy-1-fluoroethene (PubChem CID 23500967) has the molecular formula C4H5FO and a molecular weight of 88.08 g/mol. Its IUPAC name is 1-ethenoxy-1-fluoroethene.

Molecular Properties

Compound Name1-ethenoxy-1-fluoroethene
PubChem CID23500967
Molecular FormulaC4H5FO
Molecular Weight88.08 g/mol
Exact Mass88.03
IUPAC Name1-ethenoxy-1-fluoroethene
SMILESC=COC(=C)F
InChIInChI=1S/C4H5FO/c1-3-6-4(2)5/h3H,1-2H2
InChIKeyOWHPGRQGKQRWIM-UHFFFAOYSA-N
XLogP1.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.08
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-ethenoxy-1-fluoroethene?
The IUPAC name of 1-ethenoxy-1-fluoroethene (CID 23500967) is 1-ethenoxy-1-fluoroethene.
What is the SMILES notation for 1-ethenoxy-1-fluoroethene?
The canonical SMILES for 1-ethenoxy-1-fluoroethene is C=COC(=C)F.
What is the InChIKey of 1-ethenoxy-1-fluoroethene?
The InChIKey is OWHPGRQGKQRWIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5FO/c1-3-6-4(2)5/h3H,1-2H2.
What are the key properties of 1-ethenoxy-1-fluoroethene?
1-ethenoxy-1-fluoroethene has a molecular weight of 88.08 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenoxy-1-fluoroethene is sourced from PubChem (CID 23500967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).