3,4-bis(4-dodecylphenyl)phthalic acid

Systemtic Name: 3,4-bis(4-dodecylphenyl)phthalic acid Openeye Name: 3,4-bis(4-dodecylphenyl)phthalic acid CAS Name: 3,4-bis(4-dodecylphenyl)phthalic acid IUPAC Name: 3,4-bis(4-dodecylphenyl)phthalic acid Traditional Name: 3,4-bis(4-laurylphenyl)phthalic acid Formula: C44H62O4 MolecularWeight: 654.96068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C3=CC=C(C=C3)CCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)O)C(=O)O)C3=CC=C(C=C3)CCCCCCCCCCCC

InChI

InChI=1S/C44H62O4/c1-3-5-7-9-11-13-15-17-19-21-23-35-25-29-37(30-26-35)39-33-34-40(43(45)46)42(44(47)48)41(39)38-31-27-36(28-32-38)24-22-20-18-16-14-12-10-8-6-4-2/h25-34H,3-24H2,1-2H3,(H,45,46)(H,47,48)