2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane

C7H6F4O2 — CID 19692089

IUPAC2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane
SMILESC=CC1(C=C)OC(F)(F)C(F)(F)O1
InChIInChI=1S/C7H6F4O2/c1-3-5(4-2)12-6(8,9)7(10,11)13-5/h3-4H,1-2H2
InChIKeyKKYBNAPTOAPXHV-UHFFFAOYSA-N
MW198.11 g/mol
LogP2.29
Rot. Bonds2

About 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane

2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane (PubChem CID 19692089) has the molecular formula C7H6F4O2 and a molecular weight of 198.11 g/mol. Its IUPAC name is 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane.

Molecular Properties

Compound Name2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane
PubChem CID19692089
Molecular FormulaC7H6F4O2
Molecular Weight198.11 g/mol
Exact Mass198.03
IUPAC Name2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane
SMILESC=CC1(C=C)OC(F)(F)C(F)(F)O1
InChIInChI=1S/C7H6F4O2/c1-3-5(4-2)12-6(8,9)7(10,11)13-5/h3-4H,1-2H2
InChIKeyKKYBNAPTOAPXHV-UHFFFAOYSA-N
XLogP2.29
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.11
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2-Bis(trifluoromethyl)-4,5-difluoro-4,5-divinyl-1,3-dioxolane
CID 11022884
(4R,5R)-4,5-bis(ethenyl)-4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxolane
CID 11779414
2,2-Bis(trifluoromethyl)-4-vinyl-1,3-dioxolane
CID 19818990
2,2-Bis(trifluoromethyl)-4-vinyl-4,5,5-trifluoro-1,3-dioxolane
CID 19818997
2-Ethenyl-4,4-difluoro-2-(trifluoromethyl)-1,3-dioxolane
CID 21015219
2,2-Bis(ethenyl)-4,5-difluoro-1,3-dioxolane
CID 21479539
4-Ethenyl-2-fluoro-2-(trifluoromethyl)-1,3-dioxolane
CID 22891804
(4R,5R)-2,2-bis(ethenyl)-4,5-difluoro-1,3-dioxolane
CID 54387535
(4S,5S)-4,5-bis(ethenyl)-4,5-difluoro-2,2-bis(trifluoromethyl)-1,3-dioxolane
CID 54552205
2-(2,2-Difluoroethenyl)-2-methyl-1,3-dioxolane
CID 58122662
(4S,5S)-2,2-bis(ethenyl)-4,5-difluoro-1,3-dioxolane
CID 67719040
4-Fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane
CID 131973026

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane?
The IUPAC name of 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane (CID 19692089) is 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane.
What is the SMILES notation for 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane?
The canonical SMILES for 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane is C=CC1(C=C)OC(F)(F)C(F)(F)O1.
What is the InChIKey of 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane?
The InChIKey is KKYBNAPTOAPXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F4O2/c1-3-5(4-2)12-6(8,9)7(10,11)13-5/h3-4H,1-2H2.
What are the key properties of 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane?
2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane has a molecular weight of 198.11 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(ethenyl)-4,4,5,5-tetrafluoro-1,3-dioxolane is sourced from PubChem (CID 19692089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).