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The molecular formula is C30H16Cl2.
The PubChem CID is 635032.
The molecular weight is 447.3 g/mol.
The IUPAC name is 1,8-dichloro-9,10-bis(2-phenylethynyl)anthracene.
The InChI is InChI=1S/C30H16Cl2/c31-27-15-7-13-24-23(19-17-21-9-3-1-4-10-21)25-14-8-16-28(32)30(25)26(29(24)27)20-18-22-11-5-2-6-12-22/h1-16H.
The InChIKey is YONGNHJIWAYNLC-UHFFFAOYSA-N.
The canonical SMILES is C1=CC=C(C=C1)C#CC2=C3C=CC=C(C3=C(C4=C2C=CC=C4Cl)C#CC5=CC=CC=C5)Cl.
The CAS number is 51749-83-8.
Yes, 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene is a canonicalized compound.
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