5,15-DIPHENYL-10,20-DI-PYRIDIN-2-YL-PORPHYRIN DITOSYLATE SALT

CAS No.
CCD No.
CCD00783496
Formula
C42 H28 N6 . 2 C7 H8 O3 S
MolWeight
961.132

Basic Information

Product Name: 5,15-DIPHENYL-10,20-DI-PYRIDIN-2-YL-PORPHYRIN DITOSYLATE SALT
English Synonyms: 5,15-DIPHENYL-10,20-DI-PYRIDIN-2-YL-PORPHYRIN DITOSYLATE SALT
MDL Number.: MFCD09752897
H bond acceptor: 6
H bond donor: 2
Smile: Cc1ccc(cc1)S(=O)(=O)O.Cc1ccc(cc1)S(=O)(=O)O.c1ccc(cc1)/c/2c/3\cc/c(/[nH]3)c(/c4n/c(c(\c5ccc([nH]5)/c(c/6\nc2C=C6)/c7ccccn7)/c8ccccc8)/C=C4)\c9ccccn9
InChi: InChI=1S/C42H28N6.2C7H8O3S/c1-3-11-27(12-4-1)39-31-17-21-35(45-31)41(29-15-7-9-25-43-29)37-23-19-33(47-37)40(28-13-5-2-6-14-28)34-20-24-38(48-34)42(30-16-8-10-26-44-30)36-22-18-32(39)46-36;2*1-6-2-4-7(5-3-6)11(8,9)10/h1-26,45,48H;2*2-5H,1H3,(H,8,9,10)/b39-31-,39-32-,40-33-,40-34-,41-35-,41-37-,42-36-,42-38-;;
InChiKey: InChIKey=DIOXTQLTWMLGKW-IQOVTHOTSA-N

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