methanol; [2,3,5,6-tetrakis(fluoranyl)-4-methyl-phenyl]methanol; zirconium

Systemtic Name: methanol; [2,3,5,6-tetrakis(fluoranyl)-4-methyl-phenyl]methanol; zirconium Openeye Name: methanol; (2,3,5,6-tetrafluoro-4-methyl-phenyl)methanol; zirconium CAS Name: methanol; (2,3,5,6-tetrafluoro-4-methylphenyl)methanol; zirconium IUPAC Name: methanol; (2,3,5,6-tetrafluoro-4-methylphenyl)methanol; zirconium Traditional Name: methanol; (2,3,5,6-tetrafluoro-4-methyl-phenyl)methanol; zirconium Formula: C18H20F8O4Zr MolecularWeight: 543.560226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1F)F)CO)F)F.CC1=C(C(=C(C(=C1F)F)CO)F)F.CO.CO.[Zr]

Isomeric SMILES

CC1=C(C(=C(C(=C1F)F)CO)F)F.CC1=C(C(=C(C(=C1F)F)CO)F)F.CO.CO.[Zr]

InChI

InChI=1S/2C8H6F4O.2CH4O.Zr/c2*1-3-5(9)7(11)4(2-13)8(12)6(3)10;2*1-2;/h2*13H,2H2,1H3;2*2H,1H3;