Chemical Compound

J3.218.831A

J3.218.831A chemical structure
Primary Record

J3.218.831A

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102102460
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C#CC7=CC=C(C=C7)N(C)C)C8=CC(=CC(=C8)C(C)(C)C)C(C)(C)C)C#CC9=CC(=C(C=C9)C(=O)O)C(=O)O)N3)C(C)(C)C
Canonical SMILES
CN(C)c1ccc(C#Cc2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4ccc([nH]4)c(C#Cc4ccc(C(=O)O)c(C(=O)O)c4)c4ccc([nH]4)c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4nc2C=C4)C=C3)cc1

Names & Synonyms

  • J3.218.831A
  • J3.670.722D
  • 4-[10,20-Bis(3,5-di-tert-butylphenyl)-15-[4-(dimethylamino)phenylethynyl]-21H,23H-porphyrin-5-ylethynyl]phthalic acid
  • 4-[5,15-Bis(3,5-di-tert-butylphenyl)-20-[4-(dimethylamino)phenylethynyl]-21H,23H-porphyrin-10-ylethynyl]phthalic acid