2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane

C11H10F4O2 — CID 13186647

IUPAC2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane
SMILESFC(C(F)(F)F)C1(c2ccccc2)OCCO1
InChIInChI=1S/C11H10F4O2/c12-9(11(13,14)15)10(16-6-7-17-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKeyMVRRFRWAXPREBI-UHFFFAOYSA-N
MW250.19 g/mol
LogP2.79
Rot. Bonds2

About 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane

2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane (PubChem CID 13186647) has the molecular formula C11H10F4O2 and a molecular weight of 250.19 g/mol. Its IUPAC name is 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane.

Molecular Properties

Compound Name2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane
PubChem CID13186647
Molecular FormulaC11H10F4O2
Molecular Weight250.19 g/mol
Exact Mass250.06
IUPAC Name2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane
SMILESFC(C(F)(F)F)C1(c2ccccc2)OCCO1
InChIInChI=1S/C11H10F4O2/c12-9(11(13,14)15)10(16-6-7-17-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKeyMVRRFRWAXPREBI-UHFFFAOYSA-N
XLogP2.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.19
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane?
The IUPAC name of 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane (CID 13186647) is 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane.
What is the SMILES notation for 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane?
The canonical SMILES for 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane is FC(C(F)(F)F)C1(c2ccccc2)OCCO1.
What is the InChIKey of 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane?
The InChIKey is MVRRFRWAXPREBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F4O2/c12-9(11(13,14)15)10(16-6-7-17-10)8-4-2-1-3-5-8/h1-5,9H,6-7H2.
What are the key properties of 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane?
2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane has a molecular weight of 250.19 g/mol, XLogP of 2.79, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-(1,2,2,2-tetrafluoroethyl)-1,3-dioxolane is sourced from PubChem (CID 13186647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).