1,4-dioxane; 2,2,2-tris(fluoranyl)ethanoic acid; hydrate

Systemtic Name: 1,4-dioxane; 2,2,2-tris(fluoranyl)ethanoic acid; hydrate Openeye Name: 1,4-dioxane; 2,2,2-trifluoroacetic acid; hydrate CAS Name: 1,4-dioxane; 2,2,2-trifluoroacetic acid; hydrate IUPAC Name: 1,4-dioxane; 2,2,2-trifluoroacetic acid; hydrate Traditional Name: 1,4-dioxane; 2,2,2-trifluoroacetic acid; hydrate Formula: C6H11F3O5 MolecularWeight: 220.14375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCO1.C(=O)(C(F)(F)F)O.O

Isomeric SMILES

C1COCCO1.C(=O)(C(F)(F)F)O.O

InChI

InChI=1S/C4H8O2.C2HF3O2.H2O/c1-2-6-4-3-5-1;3-2(4,5)1(6)7;/h1-4H2;(H,6,7);1H2