Products 1219980-38-7

CAS 1219980-38-7 appears in our catalog under these names: 1,3,5–Tris(4–(3,5–dicarboxyphenylethynyl)phenyl)benzene, 1,3,5-Tris(4-(3,5-dicarboxyphenylethynyl)phenyl)benzene, 97%, 5,5'-((5'-(4-((3,5-Dicarboxyphenyl)Ethynyl)Phenyl)-[1,1':3',1''-Terphenyl]-4,4''-Diyl)Bis(Ethyne-2,1-Diyl))Diisophthalic Acid, 97%. Offered by: GLPBio, Fluorochem, Chemat. Available pack sizes: 1g, 250mg, 100mg.

Structural formula: {0} (CAS {1})

5-[2-[4-[3,5-bis[4-[2-(3,5-dicarboxyphenyl)ethynyl]phenyl]phenyl]phenyl]ethynyl]benzene-1,3-dicarboxylic acid (CAS 1219980-38-7) is a chemical compound with the molecular formula C54H30O12 and a molecular weight of 870.8 g/mol. IUPAC name: 5-[2-[4-[3,5-bis[4-[2-(3,5-dicarboxyphenyl)ethynyl]phenyl]phenyl]phenyl]ethynyl]benzene-1,3-dicarboxylic acid. InChIKey: MGBWLZYGYVLPHG-UHFFFAOYSA-N.

Identity
Molecular formulaC54H30O12
Molecular weight870.8 g/mol
IUPAC name5-[2-[4-[3,5-bis[4-[2-(3,5-dicarboxyphenyl)ethynyl]phenyl]phenyl]phenyl]ethynyl]benzene-1,3-dicarboxylic acid
InChIKeyMGBWLZYGYVLPHG-UHFFFAOYSA-N
SMILESC1=CC(=CC=C1C#CC2=CC(=CC(=C2)C(=O)O)C(=O)O)C3=CC(=CC(=C3)C4=CC=C(C=C4)C#CC5=CC(=CC(=C5)C(=O)O)C(=O)O)C6=CC=C(C=C6)C#CC7=CC(=CC(=C7)C(=O)O)C(=O)O

Computed by PubChem (NCBI)