Chemical Compound

J1.185.100B

J1.185.100B chemical structure
Primary Record

J1.185.100B

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
100950605
SMILES
CCCCCCC1=C(C2=C3C4=CC=CC(=C4)COC(=O)CCCCC(=O)OCC5=CC(=CC=C5)C6=C7C(=C(C(=CC8=NC(=C(C9=CC=CC(=C9)C#CC#CC4=CC(=CC=C4)C(=C4C(=C(C(=N4)C=C1N2)CCCCCC)C)C1=C(C(=C(N1)C=C1C(=C(C3=N1)C)CCCCCC)CCCCCC)C)C1=C(C(=C(N1)C=C1C(=C(C6=N1)C)CCCCCC)CCCCCC)C)C(=C8CCCCCC)C)N7)CCCCCC)C)C
Canonical SMILES
CCCCCCC1=C(C)c2nc1cc1[nH]c(c(C)c1CCCCCC)c1c3nc(cc4[nH]c(c(C)c4CCCCCC)c2-c2cccc(c2)COC(=O)CCCCC(=O)OCc2cccc(c2)-c2c4nc(cc5[nH]c(c(C)c5CCCCCC)c(c5nc(cc6[nH]c2c(C)c6CCCCCC)C(CCCCCC)=C5C)-c2cccc(c2)C#CC#Cc2cccc-1c2)C(CCCCCC)=C4C)C(CCCCCC)=C3C

Names & Synonyms

  • J1.185.100B
  • J1.474.932B
  • 15,15 -(1,6-Dioxohexane-1,6-diyl)bis(oxymethylene)bis(1,3-phenylene)[5,5 -(1,3-butadiyne-1,4-diyl)bis(1,3-phenylene)bis(2,8,12,18-tetrahexyl-3,7,13,17-tetramethyl-21H,23H-porphyrin)]
  • 20,20 -[Tetramethylenebis(carbonyloxymethylene-m-phenylene)]-[10,10 -[(1,3-butadiyne-1,4-diyl)bis(m-phenylene)]bis(2,8,12,18-tetramethyl-3,7,13,17-tetrahexyl-21H,23H-porphyrin)]