Chemical Compound

J3.129.134H

J3.129.134H chemical structure
Primary Record

J3.129.134H

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102346221
SMILES
CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=C(C4=CC5=C=C=C=C=C6C=C7C(=C8C=CC(=N8)C(=C9C=CC(=C(C1=CC(=C=C=C=C=C8C=C%10C(=C%11C=CC(=C(C%12=NC(=C(C%13=CC(=C=C=C=C=C%14C=C(C(=C%15C=CC2=N%15)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)NC%14=CC5=N4)C(=CC8=N%10)N%13)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C=C%12)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)N%11)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C(=N1)C=C6N7)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)N9)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C)N3)C(C)(C)C
Canonical SMILES
CC(C)(C)c1cc(-c2c3nc(c(-c4cc(C(C)(C)C)cc(C(C)(C)C)c4)c4cc5c(cc6nc(c(-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)c7ccc2[nH]7)=CC6=C=C=C=C=C2C=c6nc2cc2[nH]c(cc2=C=C=C=C=c2cc7[nH]c2cc2nc(c(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)c8ccc([nH]8)c(-c8cc(C(C)(C)C)cc(C(C)(C)C)c8)c8nc(c7-c7cc(C(C)(C)C)cc(C(C)(C)C)c7)C=C8)=CC2=C=C=C=C=5)c(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2)c2nc(c(-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)c5ccc([nH]5)c6-c5cc(C(C)(C)C)cc(C(C)(C)C)c5)C=C2)[nH]4)C=C3)cc(C(C)(C)C)c1

Names & Synonyms

  • J3.129.134H
  • J3.149.379J
  • 13,17-[1,3-Butadiyne-1,4-diylbis[5,15,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-12,8-diyl(1,3-butadiyne-1,4-diyl)]]-5,10,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin
  • 18,18 -[5,10,15-Tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-2,18-diylbis(1,3-butadiyne-1,4-diyl)][2,2 -(1,3-butadiyne-1,4-diyl)bis(5,10,15-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin)]
  • 8,12-[1,3-Butadiyne-1,4-diylbis[5,15,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin-12,8-diyl(1,3-butadiyne-4,1-diyl)]]-5,15,20-tris(3,5-di-tert-butylphenyl)-21H,23H-porphyrin