2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane

C8F14O2 — CID 23085487

IUPAC2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane
SMILESFC(F)=C1OC(F)(C(F)(F)C(F)(F)F)C(F)(C(F)(F)C(F)(F)F)O1
InChIInChI=1S/C8F14O2/c9-1(10)2-23-5(15,3(11,12)7(17,18)19)6(16,24-2)4(13,14)8(20,21)22
InChIKeyTXIJVGOHNLNNDM-UHFFFAOYSA-N
MW394.06 g/mol
LogP4.83
Rot. Bonds2

About 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane

2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane (PubChem CID 23085487) has the molecular formula C8F14O2 and a molecular weight of 394.06 g/mol. Its IUPAC name is 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane
PubChem CID23085487
Molecular FormulaC8F14O2
Molecular Weight394.06 g/mol
Exact Mass393.97
IUPAC Name2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane
SMILESFC(F)=C1OC(F)(C(F)(F)C(F)(F)F)C(F)(C(F)(F)C(F)(F)F)O1
InChIInChI=1S/C8F14O2/c9-1(10)2-23-5(15,3(11,12)7(17,18)19)6(16,24-2)4(13,14)8(20,21)22
InChIKeyTXIJVGOHNLNNDM-UHFFFAOYSA-N
XLogP4.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.06
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Analyze 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane with MolForge

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Related Compounds

2-(Difluoromethylene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 86530
2-(Difluoromethylene)-4,5-difluoro-4,5-bis(trifluoromethyl)-1,3-dioxole
CID 23085488
(5R)-2-(difluoromethylidene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 98110089
4,5-Difluoro-2-(1,1,2,2,3,3,3-heptafluoropropyl)-2-(1,1,2,2,2-pentafluoroethyl)-1,3-dioxole
CID 22133713
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-1,3-dioxolane
CID 23085484
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,3,3,3-heptafluoropropyl)-1,3-dioxolane
CID 23085489
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane
CID 23085490
2-(Difluoromethylidene)-4-[difluoro(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)methyl]-4,5,5-trifluoro-1,3-dioxolane
CID 57687855
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-1,3-dioxolane
CID 59593690
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane;1,1,2,2-tetrafluoroethene
CID 88752531
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,3,3,4-heptafluorobutyl)-1,3-dioxolane
CID 117836174
2-(Difluoromethylidene)-4,4-difluoro-5-(trifluoromethoxy)-5-(trifluoromethyl)-1,3-dioxolane
CID 122655769

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane?
The IUPAC name of 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane (CID 23085487) is 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane.
What is the SMILES notation for 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane?
The canonical SMILES for 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane is FC(F)=C1OC(F)(C(F)(F)C(F)(F)F)C(F)(C(F)(F)C(F)(F)F)O1.
What is the InChIKey of 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane?
The InChIKey is TXIJVGOHNLNNDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8F14O2/c9-1(10)2-23-5(15,3(11,12)7(17,18)19)6(16,24-2)4(13,14)8(20,21)22.
What are the key properties of 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane?
2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane has a molecular weight of 394.06 g/mol, XLogP of 4.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethylidene)-4,5-difluoro-4,5-bis(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane is sourced from PubChem (CID 23085487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).