2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane

C5H5F5O2 — CID 21441863

IUPAC2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane
SMILESFC(F)C1(C(F)(F)F)OCCO1
InChIInChI=1S/C5H5F5O2/c6-3(7)4(5(8,9)10)11-1-2-12-4/h3H,1-2H2
InChIKeyVOAHUGZEANRHTC-UHFFFAOYSA-N
MW192.08 g/mol
LogP1.56
Rot. Bonds1

About 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane

2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane (PubChem CID 21441863) has the molecular formula C5H5F5O2 and a molecular weight of 192.08 g/mol. Its IUPAC name is 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane
PubChem CID21441863
Molecular FormulaC5H5F5O2
Molecular Weight192.08 g/mol
Exact Mass192.02
IUPAC Name2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane
SMILESFC(F)C1(C(F)(F)F)OCCO1
InChIInChI=1S/C5H5F5O2/c6-3(7)4(5(8,9)10)11-1-2-12-4/h3H,1-2H2
InChIKeyVOAHUGZEANRHTC-UHFFFAOYSA-N
XLogP1.56
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.08
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane?
The IUPAC name of 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane (CID 21441863) is 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane.
What is the SMILES notation for 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane?
The canonical SMILES for 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane is FC(F)C1(C(F)(F)F)OCCO1.
What is the InChIKey of 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane?
The InChIKey is VOAHUGZEANRHTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5F5O2/c6-3(7)4(5(8,9)10)11-1-2-12-4/h3H,1-2H2.
What are the key properties of 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane?
2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane has a molecular weight of 192.08 g/mol, XLogP of 1.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-2-(trifluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 21441863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).