Chemical Compound

2-(4-{4,4'-dihexyl-5'-[(5E)-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-5-en-1,3-diyn-1-yl]-[2,2'-bithiophen]-5-yl}buta-1,3-diyn-1-yl)-4,5,9,10,14,15,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene

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2-(4-{4,4'-dihexyl-5'-[(5E)-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-5-en-1,3-diyn-1-yl]-[2,2'-bithiophen]-5-yl}buta-1,3-diyn-1-yl)-4,5,9,10,14,15,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene 结构式
Primary record

2-(4-{4,4'-dihexyl-5'-[(5E)-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-5-en-1,3-diyn-1-yl]-[2,2'-bithiophen]-5-yl}buta-1,3-diyn-1-yl)-4,5,9,10,14,15,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
101478909
SMILES
CCCCCCC1=C(SC(=C1)C2=CC(=C(S2)C#CC#CC3=C4C(=C(C(=N4)C=C5C(=C(C(=CC6=C(C(=C(N6)C=C7C(=C(C3=N7)CC)CC)CC)CC)N5)CC)CC)CC)CC)CCCCCC)C#CC#C/C=C/C8=C(CCCC8(C)C)C
Canonical SMILES
CCCCCCc1cc(-c2cc(CCCCCC)c(C#CC#Cc3c4nc(cc5[nH]c(cc6[nH]c(cc7nc3C(CC)=C7CC)c(CC)c6CC)c(CC)c5CC)C(CC)=C4CC)s2)sc1C#CC#C/C=C/C1=C(C)CCCC1(C)C

名称与同义词

  • J2.741.210F
  • 2-(4-{4,4'-dihexyl-5'-[(5E)-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-5-en-1,3-diyn-1-yl]-[2,2'-bithiophen]-5-yl}buta-1,3-diyn-1-yl)-4,5,9,10,14,15,19,20-octaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene
  • 5-[4-[5 -[(E)-6-(2,6,6-Trimethyl-1-cyclohexenyl)-5-hexene-1,3-diynyl]-4,4 -dihexyl-2,2 -bithiophene-5-yl]-1,3-butadiynyl]-2,3,7,8,12,13,17,18-octaethyl-21H,23H-porphyrin