4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane

C5H2F6O2 — CID 20735783

IUPAC4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane
SMILESC=C1OC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C5H2F6O2/c1-2-12-3(6,4(7,8)9)5(10,11)13-2/h1H2
InChIKeyNIIPTVPBKNBLJC-UHFFFAOYSA-N
MW208.06 g/mol
LogP2.33
Rot. Bonds

About 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane

4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane (PubChem CID 20735783) has the molecular formula C5H2F6O2 and a molecular weight of 208.06 g/mol. Its IUPAC name is 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane
PubChem CID20735783
Molecular FormulaC5H2F6O2
Molecular Weight208.06 g/mol
Exact Mass208.00
IUPAC Name4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane
SMILESC=C1OC(F)(F)C(F)(C(F)(F)F)O1
InChIInChI=1S/C5H2F6O2/c1-2-12-3(6,4(7,8)9)5(10,11)13-2/h1H2
InChIKeyNIIPTVPBKNBLJC-UHFFFAOYSA-N
XLogP2.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.06
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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
1,1-Difluoroethene;2-(difluoromethylidene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 44144899
(5R)-2-(difluoromethylidene)-4,4,5-trifluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 98110089
2-(Difluoromethylidene)-4,4-difluoro-5-(trifluoromethyl)-1,3-dioxolane
CID 11333603
4,4,5,5-Tetrafluoro-2-methylidene-1,3-dioxolane
CID 18335875
4,5-Difluoro-2-methylidene-4,5-bis(trifluoromethyl)-1,3-dioxolane
CID 18335876
2,2,4,4,5-Pentafluoro-5-methyl-1,3-dioxolane
CID 19745411
4,5,5-Trifluoro-4-methyl-2-methylene-1,3-dioxolane
CID 22025806
2-(Difluoromethylidene)-4,4,5-trifluoro-5-(1,1,2,2,2-pentafluoroethyl)-1,3-dioxolane
CID 23085490
2-(Difluoromethylidene)-4-fluoro-4-(fluoromethyl)-1,3-dioxolane
CID 57972474
2-(Difluoromethylidene)-4,5-difluoro-4,5-dimethyl-1,3-dioxolane
CID 57983737

Frequently Asked Questions

What is the IUPAC name of 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane?
The IUPAC name of 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane (CID 20735783) is 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane.
What is the SMILES notation for 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane?
The canonical SMILES for 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane is C=C1OC(F)(F)C(F)(C(F)(F)F)O1.
What is the InChIKey of 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane?
The InChIKey is NIIPTVPBKNBLJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F6O2/c1-2-12-3(6,4(7,8)9)5(10,11)13-2/h1H2.
What are the key properties of 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane?
4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane has a molecular weight of 208.06 g/mol, XLogP of 2.33, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,5-trifluoro-2-methylidene-5-(trifluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 20735783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).