Chem
J-GLOBAL ID：201407089548104670   Nikkaji number：J3.239.529E

22-(2,3-Dihydroxypropoxy)phthalocyanine

22-(2,3-ジヒドロキシプロポキシ)フタロシアニン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C35H24N8O3
Molecular formula furigana： C35-H24-N8-O3
Molecular weight： 604.630
InChI： InChI=1S/C35H24N8O3/c44-16-18(45)17-46-19-13-14-26-27(15-19)35-42-33-25-12-6-5-11-24(25)31(40-33)38-29-21-8-2-1-7-20(21)28(36-29)37-30-22-9-3-4-10-23(22)32(39-30)41-34(26)43-35/h1-15,18,44-45H,16-17H2,(H2,36,37,38,39,40,41,42,43)
InChI key： PLUOZGUWHCQZJM-UHFFFAOYSA-N
SMILES： OCC(O)COc1ccc2c3/N=C/4\N=C(/N=c/5\[nH]/c(=N\C6=N/C(=N\c([nH]3)c2c1)/c1ccccc61)/c1ccccc51)c1ccccc41
Systematic name  (3)：
  • 22-(2,3-ジヒドロキシプロポキシ)フタロシアニン
  • 3-{2,11,20,29,37,38,39,40-オクタアザノナシクロ[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]テトラコンタ-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-ノナデカエン-6-イルオキシ}プロパン-1,2-ジオール
  • 3-{2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3,5,7,9,11,13,15,17,19(39),20,22,24,26,28,30(37),31,33,35-nonadecaen-6-yloxy}propane-1,2-diol
Other name (1)：
  • 22-(2,3-Dihydroxypropoxy)phthalocyanine
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