2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane

C9H2F10O4 — CID 89284029

IUPAC2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane
SMILESFC(F)=C1OC(F)(F)C(F)(CC2(F)OC(=C(F)F)OC2(F)F)O1
InChIInChI=1S/C9H2F10O4/c10-2(11)4-20-6(14,8(16,17)22-4)1-7(15)9(18,19)23-5(21-7)3(12)13/h1H2
InChIKeyCCLJOEQODXUGEK-UHFFFAOYSA-N
MW364.09 g/mol
LogP4.12
Rot. Bonds2

About 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane

2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane (PubChem CID 89284029) has the molecular formula C9H2F10O4 and a molecular weight of 364.09 g/mol. Its IUPAC name is 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane.

Molecular Properties

Compound Name2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane
PubChem CID89284029
Molecular FormulaC9H2F10O4
Molecular Weight364.09 g/mol
Exact Mass363.98
IUPAC Name2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane
SMILESFC(F)=C1OC(F)(F)C(F)(CC2(F)OC(=C(F)F)OC2(F)F)O1
InChIInChI=1S/C9H2F10O4/c10-2(11)4-20-6(14,8(16,17)22-4)1-7(15)9(18,19)23-5(21-7)3(12)13/h1H2
InChIKeyCCLJOEQODXUGEK-UHFFFAOYSA-N
XLogP4.12
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.09
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane?
The IUPAC name of 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane (CID 89284029) is 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane.
What is the SMILES notation for 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane?
The canonical SMILES for 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane is FC(F)=C1OC(F)(F)C(F)(CC2(F)OC(=C(F)F)OC2(F)F)O1.
What is the InChIKey of 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane?
The InChIKey is CCLJOEQODXUGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H2F10O4/c10-2(11)4-20-6(14,8(16,17)22-4)1-7(15)9(18,19)23-5(21-7)3(12)13/h1H2.
What are the key properties of 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane?
2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane has a molecular weight of 364.09 g/mol, XLogP of 4.12, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethylidene)-4-[[2-(difluoromethylidene)-4,5,5-trifluoro-1,3-dioxolan-4-yl]methyl]-4,5,5-trifluoro-1,3-dioxolane is sourced from PubChem (CID 89284029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).