4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane

C15H10F16O4 — CID 160564089

IUPAC4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane
SMILESCC1(C(F)(F)C(F)=C(F)F)OCC(F)(C(F)(F)F)O1.CC1(C(F)=C(F)F)OCC(F)(C(F)(F)F)O1
InChIInChI=1S/C8H5F9O2.C7H5F7O2/c1-5(7(13,14)3(9)4(10)11)18-2-6(12,19-5)8(15,16)17;1-5(3(8)4(9)10)15-2-6(11,16-5)7(12,13)14/h2H2,1H3;2H2,1H3
InChIKeyQZRSPGITOVSLJK-UHFFFAOYSA-N
MW558.21 g/mol
LogP6.75
Rot. Bonds3

About 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane

4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane (PubChem CID 160564089) has the molecular formula C15H10F16O4 and a molecular weight of 558.21 g/mol. Its IUPAC name is 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane.

Molecular Properties

Compound Name4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane
PubChem CID160564089
Molecular FormulaC15H10F16O4
Molecular Weight558.21 g/mol
Exact Mass558.03
IUPAC Name4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane
SMILESCC1(C(F)(F)C(F)=C(F)F)OCC(F)(C(F)(F)F)O1.CC1(C(F)=C(F)F)OCC(F)(C(F)(F)F)O1
InChIInChI=1S/C8H5F9O2.C7H5F7O2/c1-5(7(13,14)3(9)4(10)11)18-2-6(12,19-5)8(15,16)17;1-5(3(8)4(9)10)15-2-6(11,16-5)7(12,13)14/h2H2,1H3;2H2,1H3
InChIKeyQZRSPGITOVSLJK-UHFFFAOYSA-N
XLogP6.75
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500558.21
LogP ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane?
The IUPAC name of 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane (CID 160564089) is 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane.
What is the SMILES notation for 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane?
The canonical SMILES for 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane is CC1(C(F)(F)C(F)=C(F)F)OCC(F)(C(F)(F)F)O1.CC1(C(F)=C(F)F)OCC(F)(C(F)(F)F)O1.
What is the InChIKey of 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane?
The InChIKey is QZRSPGITOVSLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F9O2.C7H5F7O2/c1-5(7(13,14)3(9)4(10)11)18-2-6(12,19-5)8(15,16)17;1-5(3(8)4(9)10)15-2-6(11,16-5)7(12,13)14/h2H2,1H3;2H2,1H3.
What are the key properties of 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane?
4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane has a molecular weight of 558.21 g/mol, XLogP of 6.75, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-methyl-2-(1,1,2,3,3-pentafluoroprop-2-enyl)-4-(trifluoromethyl)-1,3-dioxolane;4-fluoro-2-methyl-2-(1,2,2-trifluoroethenyl)-4-(trifluoromethyl)-1,3-dioxolane is sourced from PubChem (CID 160564089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).