4-fluoro-4-methyl-2-methylidene-1,3-dioxolane

C5H7FO2 — CID 54185990

IUPAC4-fluoro-4-methyl-2-methylidene-1,3-dioxolane
SMILESC=C1OCC(C)(F)O1
InChIInChI=1S/C5H7FO2/c1-4-7-3-5(2,6)8-4/h1,3H2,2H3
InChIKeyPFDLQPCKSXGGGT-UHFFFAOYSA-N
MW118.11 g/mol
LogP1.19
Rot. Bonds

About 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane

4-fluoro-4-methyl-2-methylidene-1,3-dioxolane (PubChem CID 54185990) has the molecular formula C5H7FO2 and a molecular weight of 118.11 g/mol. Its IUPAC name is 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane.

Molecular Properties

Compound Name4-fluoro-4-methyl-2-methylidene-1,3-dioxolane
PubChem CID54185990
Molecular FormulaC5H7FO2
Molecular Weight118.11 g/mol
Exact Mass118.04
IUPAC Name4-fluoro-4-methyl-2-methylidene-1,3-dioxolane
SMILESC=C1OCC(C)(F)O1
InChIInChI=1S/C5H7FO2/c1-4-7-3-5(2,6)8-4/h1,3H2,2H3
InChIKeyPFDLQPCKSXGGGT-UHFFFAOYSA-N
XLogP1.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.11
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane?
The IUPAC name of 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane (CID 54185990) is 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane.
What is the SMILES notation for 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane?
The canonical SMILES for 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane is C=C1OCC(C)(F)O1.
What is the InChIKey of 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane?
The InChIKey is PFDLQPCKSXGGGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FO2/c1-4-7-3-5(2,6)8-4/h1,3H2,2H3.
What are the key properties of 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane?
4-fluoro-4-methyl-2-methylidene-1,3-dioxolane has a molecular weight of 118.11 g/mol, XLogP of 1.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-4-methyl-2-methylidene-1,3-dioxolane is sourced from PubChem (CID 54185990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).