(4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one

C4H3FO3 — CID 118126719

IUPAC(4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one
SMILESO=C1OC/C(=C/F)O1
InChIInChI=1S/C4H3FO3/c5-1-3-2-7-4(6)8-3/h1H,2H2/b3-1-
InChIKeyPYZBAMBYMZLIFO-IWQZZHSRSA-N
MW118.06 g/mol
LogP0.96
Rot. Bonds

About (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one

(4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one (PubChem CID 118126719) has the molecular formula C4H3FO3 and a molecular weight of 118.06 g/mol. Its IUPAC name is (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one.

Molecular Properties

Compound Name(4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one
PubChem CID118126719
Molecular FormulaC4H3FO3
Molecular Weight118.06 g/mol
Exact Mass118.01
IUPAC Name(4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one
SMILESO=C1OC/C(=C/F)O1
InChIInChI=1S/C4H3FO3/c5-1-3-2-7-4(6)8-3/h1H,2H2/b3-1-
InChIKeyPYZBAMBYMZLIFO-IWQZZHSRSA-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 (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one?
The IUPAC name of (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one (CID 118126719) is (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one.
What is the SMILES notation for (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one?
The canonical SMILES for (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one is O=C1OC/C(=C/F)O1.
What is the InChIKey of (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one?
The InChIKey is PYZBAMBYMZLIFO-IWQZZHSRSA-N. The full InChI is InChI=1S/C4H3FO3/c5-1-3-2-7-4(6)8-3/h1H,2H2/b3-1-.
What are the key properties of (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one?
(4Z)-4-(fluoromethylidene)-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 (4Z)-4-(fluoromethylidene)-1,3-dioxolan-2-one is sourced from PubChem (CID 118126719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).