3-[4-(trifluoromethyl)phenyl]prop-2-yne-1,1-diol

Systemtic Name: 3-[4-(trifluoromethyl)phenyl]prop-2-yne-1,1-diol Openeye Name: 3-[4-(trifluoromethyl)phenyl]prop-2-yne-1,1-diol CAS Name: 3-[4-(trifluoromethyl)phenyl]-2-propyne-1,1-diol IUPAC Name: 3-[4-(trifluoromethyl)phenyl]prop-2-yne-1,1-diol Traditional Name: 3-[4-(trifluoromethyl)phenyl]prop-2-yne-1,1-diol Formula: C10H7F3O2 MolecularWeight: 216.15659

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CC(O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C#CC(O)O)C(F)(F)F

InChI

InChI=1S/C10H7F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-2,4-5,9,14-15H