4-fluoro-5-(fluoromethyl)-1,3-dioxolane

C4H6F2O2 — CID 59550057

IUPAC4-fluoro-5-(fluoromethyl)-1,3-dioxolane
SMILESFCC1OCOC1F
InChIInChI=1S/C4H6F2O2/c5-1-3-4(6)8-2-7-3/h3-4H,1-2H2
InChIKeyVJWKGENSZLMWKK-UHFFFAOYSA-N
MW124.09 g/mol
LogP0.62
Rot. Bonds1

About 4-fluoro-5-(fluoromethyl)-1,3-dioxolane

4-fluoro-5-(fluoromethyl)-1,3-dioxolane (PubChem CID 59550057) has the molecular formula C4H6F2O2 and a molecular weight of 124.09 g/mol. Its IUPAC name is 4-fluoro-5-(fluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name4-fluoro-5-(fluoromethyl)-1,3-dioxolane
PubChem CID59550057
Molecular FormulaC4H6F2O2
Molecular Weight124.09 g/mol
Exact Mass124.03
IUPAC Name4-fluoro-5-(fluoromethyl)-1,3-dioxolane
SMILESFCC1OCOC1F
InChIInChI=1S/C4H6F2O2/c5-1-3-4(6)8-2-7-3/h3-4H,1-2H2
InChIKeyVJWKGENSZLMWKK-UHFFFAOYSA-N
XLogP0.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.09
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-fluoro-5-(fluoromethyl)-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(Fluoromethyl)-1,3-dioxolan-2-one
CID 11708057
2,2-Difluoro-4,5-dimethyl-1,3-dioxolane
CID 18923912
(4R,5R)-4,5-bis(fluoromethyl)-2,2-dimethyl-1,3-dioxolane
CID 7021497
4,5-Bis(fluoromethyl)-2,2-dimethyl-1,3-dioxolane
CID 5195380
2,2-Difluoro-4-methyl-1,3-dioxolane
CID 11040697
4-Fluoro-4-methyl-1,3-dioxolane
CID 17876703
2,4-Difluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 17876705
4,5-Difluoro-4-(trifluoromethyl)-1,3-dioxolane
CID 17876712
4-Difluoromethyl-[1,3]dioxolan-2-one
CID 18413638
2-Fluoro-4-methyl-1,3-dioxolane
CID 18923916
2,2,4,4-Tetrafluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 19745405
4-(Fluoromethyl)-1,3-dioxolane
CID 20187650

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-5-(fluoromethyl)-1,3-dioxolane?
The IUPAC name of 4-fluoro-5-(fluoromethyl)-1,3-dioxolane (CID 59550057) is 4-fluoro-5-(fluoromethyl)-1,3-dioxolane.
What is the SMILES notation for 4-fluoro-5-(fluoromethyl)-1,3-dioxolane?
The canonical SMILES for 4-fluoro-5-(fluoromethyl)-1,3-dioxolane is FCC1OCOC1F.
What is the InChIKey of 4-fluoro-5-(fluoromethyl)-1,3-dioxolane?
The InChIKey is VJWKGENSZLMWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6F2O2/c5-1-3-4(6)8-2-7-3/h3-4H,1-2H2.
What are the key properties of 4-fluoro-5-(fluoromethyl)-1,3-dioxolane?
4-fluoro-5-(fluoromethyl)-1,3-dioxolane has a molecular weight of 124.09 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-5-(fluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 59550057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).