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

C4H3FO3 — CID 89425137

IUPAC4-fluoro-5-methylidene-1,3-dioxolan-2-one
SMILESC=C1OC(=O)OC1F
InChIInChI=1S/C4H3FO3/c1-2-3(5)8-4(6)7-2/h3H,1H2
InChIKeyOWSYYIDLGYAFQB-UHFFFAOYSA-N
MW118.06 g/mol
LogP0.96
Rot. Bonds

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

4-fluoro-5-methylidene-1,3-dioxolan-2-one (PubChem CID 89425137) has the molecular formula C4H3FO3 and a molecular weight of 118.06 g/mol. Its IUPAC name is 4-fluoro-5-methylidene-1,3-dioxolan-2-one.

Molecular Properties

Compound Name4-fluoro-5-methylidene-1,3-dioxolan-2-one
PubChem CID89425137
Molecular FormulaC4H3FO3
Molecular Weight118.06 g/mol
Exact Mass118.01
IUPAC Name4-fluoro-5-methylidene-1,3-dioxolan-2-one
SMILESC=C1OC(=O)OC1F
InChIInChI=1S/C4H3FO3/c1-2-3(5)8-4(6)7-2/h3H,1H2
InChIKeyOWSYYIDLGYAFQB-UHFFFAOYSA-N
XLogP0.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.06
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-5-methylidene-1,3-dioxolan-2-one?
The IUPAC name of 4-fluoro-5-methylidene-1,3-dioxolan-2-one (CID 89425137) is 4-fluoro-5-methylidene-1,3-dioxolan-2-one.
What is the SMILES notation for 4-fluoro-5-methylidene-1,3-dioxolan-2-one?
The canonical SMILES for 4-fluoro-5-methylidene-1,3-dioxolan-2-one is C=C1OC(=O)OC1F.
What is the InChIKey of 4-fluoro-5-methylidene-1,3-dioxolan-2-one?
The InChIKey is OWSYYIDLGYAFQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3FO3/c1-2-3(5)8-4(6)7-2/h3H,1H2.
What are the key properties of 4-fluoro-5-methylidene-1,3-dioxolan-2-one?
4-fluoro-5-methylidene-1,3-dioxolan-2-one has a molecular weight of 118.06 g/mol, XLogP of 0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-5-methylidene-1,3-dioxolan-2-one is sourced from PubChem (CID 89425137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).