4-ethenyl-5-fluoro-1,3-dioxolan-2-one

C5H5FO3 — CID 69479805

IUPAC4-ethenyl-5-fluoro-1,3-dioxolan-2-one
SMILESC=CC1OC(=O)OC1F
InChIInChI=1S/C5H5FO3/c1-2-3-4(6)9-5(7)8-3/h2-4H,1H2
InChIKeyXKNXOLSDXJMBSY-UHFFFAOYSA-N
MW132.09 g/mol
LogP1.00
Rot. Bonds1

About 4-ethenyl-5-fluoro-1,3-dioxolan-2-one

4-ethenyl-5-fluoro-1,3-dioxolan-2-one (PubChem CID 69479805) has the molecular formula C5H5FO3 and a molecular weight of 132.09 g/mol. Its IUPAC name is 4-ethenyl-5-fluoro-1,3-dioxolan-2-one.

Molecular Properties

Compound Name4-ethenyl-5-fluoro-1,3-dioxolan-2-one
PubChem CID69479805
Molecular FormulaC5H5FO3
Molecular Weight132.09 g/mol
Exact Mass132.02
IUPAC Name4-ethenyl-5-fluoro-1,3-dioxolan-2-one
SMILESC=CC1OC(=O)OC1F
InChIInChI=1S/C5H5FO3/c1-2-3-4(6)9-5(7)8-3/h2-4H,1H2
InChIKeyXKNXOLSDXJMBSY-UHFFFAOYSA-N
XLogP1.00
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.09
LogP ≤ 51.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1,3-Dioxolan-2-one, 4-ethenyl-
CID 2735038
(S)-4-Ethenyl-1,3-dioxolan-2-one
CID 6951171
(4R)-4-ethenyl-1,3-dioxolan-2-one
CID 2735039
4,5-Divinyl-1,3-dioxolan-2-one
CID 11651165
4-Vinyl-1,3-dioxolane
CID 19388283
4-Ethenyl-5-methylidene-1,3-dioxolan-2-one
CID 89425105
2,2-Bis(trifluoromethyl)-4-vinyl-1,3-dioxolane
CID 19818990
4-Ethenyl-2-fluoro-2-(trifluoromethyl)-1,3-dioxolane
CID 22891804
4-(1-Fluoroprop-2-enyl)-1,3-dioxolan-2-one
CID 68110329
4-(3-Fluoroprop-2-enyl)-1,3-dioxolan-2-one
CID 68110330
4-(1-Fluoroethenyl)-1,3-dioxolan-2-one
CID 69479594
4-[(E)-2-fluoroethenyl]-1,3-dioxolan-2-one
CID 69479728

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-5-fluoro-1,3-dioxolan-2-one?
The IUPAC name of 4-ethenyl-5-fluoro-1,3-dioxolan-2-one (CID 69479805) is 4-ethenyl-5-fluoro-1,3-dioxolan-2-one.
What is the SMILES notation for 4-ethenyl-5-fluoro-1,3-dioxolan-2-one?
The canonical SMILES for 4-ethenyl-5-fluoro-1,3-dioxolan-2-one is C=CC1OC(=O)OC1F.
What is the InChIKey of 4-ethenyl-5-fluoro-1,3-dioxolan-2-one?
The InChIKey is XKNXOLSDXJMBSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FO3/c1-2-3-4(6)9-5(7)8-3/h2-4H,1H2.
What are the key properties of 4-ethenyl-5-fluoro-1,3-dioxolan-2-one?
4-ethenyl-5-fluoro-1,3-dioxolan-2-one has a molecular weight of 132.09 g/mol, XLogP of 1.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-5-fluoro-1,3-dioxolan-2-one is sourced from PubChem (CID 69479805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).