2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole

C6HF7O2 — CID 87328984

IUPAC2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole
SMILESFC(F)=C(F)C(F)(F)C1=C(F)OC(F)O1
InChIInChI=1S/C6HF7O2/c7-1(3(8)9)6(12,13)2-4(10)15-5(11)14-2/h5H
InChIKeyMALLWCMPWUMNMW-UHFFFAOYSA-N
MW238.06 g/mol
LogP3.14
Rot. Bonds2

About 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole

2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole (PubChem CID 87328984) has the molecular formula C6HF7O2 and a molecular weight of 238.06 g/mol. Its IUPAC name is 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole.

Molecular Properties

Compound Name2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole
PubChem CID87328984
Molecular FormulaC6HF7O2
Molecular Weight238.06 g/mol
Exact Mass237.99
IUPAC Name2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole
SMILESFC(F)=C(F)C(F)(F)C1=C(F)OC(F)O1
InChIInChI=1S/C6HF7O2/c7-1(3(8)9)6(12,13)2-4(10)15-5(11)14-2/h5H
InChIKeyMALLWCMPWUMNMW-UHFFFAOYSA-N
XLogP3.14
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.06
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole?
The IUPAC name of 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole (CID 87328984) is 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole.
What is the SMILES notation for 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole?
The canonical SMILES for 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole is FC(F)=C(F)C(F)(F)C1=C(F)OC(F)O1.
What is the InChIKey of 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole?
The InChIKey is MALLWCMPWUMNMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6HF7O2/c7-1(3(8)9)6(12,13)2-4(10)15-5(11)14-2/h5H.
What are the key properties of 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole?
2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole has a molecular weight of 238.06 g/mol, XLogP of 3.14, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-5-(1,1,2,3,3-pentafluoroprop-2-enyl)-1,3-dioxole is sourced from PubChem (CID 87328984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).