Chemical Compound

J2.720.930K

J2.720.930K chemical structure
Primary Record

J2.720.930K

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
101466243
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)C8=CC(=CC(=C8)C(C)(C)C)C(C)(C)C)C=C4)C#CC9=C1C=CC(=C(C2=NC(=C(C4=CC=C(N4)C(=C4C=CC9=N4)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C#CC4=C5C=CC(=C(C6=NC(=C(C7=CC=C(N7)C(=C7C=CC4=N7)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)C=C6)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C)N5)C=C2)C2=CC=C(C=C2)C(=O)O)N1)N3)C(C)(C)C
Canonical SMILES
CC(C)(C)c1cc(-c2c3nc(c(C#Cc4c5nc(c(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6ccc([nH]6)c(-c6cc(C(C)(C)C)cc(C(C)(C)C)c6)c6nc(c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccc4[nH]7)C=C6)C=C5)c4ccc([nH]4)c(-c4ccc(C(=O)O)cc4)c4nc(c(C#Cc5c6nc(c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccc([nH]7)c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7nc(c(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)c8ccc5[nH]8)C=C7)C=C6)c5ccc2[nH]5)C=C4)C=C3)cc(C(C)(C)C)c1

Names & Synonyms

  • J2.720.930K
  • J3.269.423C
  • 4-[5,15-Bis[10,15,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-5-ylethynyl]-20-(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-10-yl]benzoic acid
  • 5,15-Bis[[10,15,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-5-yl]ethynyl]-10-(3,5-di-tert-butylphenyl)-20-(4-carboxyphenyl)-21H,23H-porphyrin