1-ethynyl-3-fluoranyl-benzene; 1-ethynyl-4-fluoranyl-benzene

Systemtic Name: 1-ethynyl-3-fluoranyl-benzene; 1-ethynyl-4-fluoranyl-benzene Openeye Name: 1-ethynyl-3-fluoro-benzene; 1-ethynyl-4-fluoro-benzene CAS Name: 1-ethynyl-3-fluorobenzene; 1-ethynyl-4-fluorobenzene IUPAC Name: 1-ethynyl-3-fluorobenzene; 1-ethynyl-4-fluorobenzene Traditional Name: 1-ethynyl-3-fluoro-benzene; 1-ethynyl-4-fluoro-benzene Formula: C16H10F2 MolecularWeight: 240.247406

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC=C(C=C1)F.C#CC1=CC(=CC=C1)F

Isomeric SMILES

C#CC1=CC=C(C=C1)F.C#CC1=CC(=CC=C1)F

InChI

InChI=1S/2C8H5F/c1-2-7-3-5-8(9)6-4-7;1-2-7-4-3-5-8(9)6-7/h2*1,3-6H