52629-20-6
COBALT(II) 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-HEXADECAFLUORO-29H,31H-PHTHALOCYANINE
Name
COBALT(II) 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-HEXADECAFLUORO-29H,31H-PHTHALOCYANINE
Formula
C32 Co F16 N8
MolWeight
859.309
1Identification
【Name】
COBALT(II) 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-HEXADECAFLUORO-29H,31H-PHTHALOCYANINE
【CAS】
【MDL】
MFCD00274641
【English Synonyms】
【Formula】
C32 Co F16 N8
【MolWeight】
859.309
【Inchi】
InChI=1S/C32F16N8.Co/c33-9-1-2(10(34)18(42)17(9)41)26-49-25(1)53-27-3-4(12(36)20(44)19(43)11(3)35)29(50-27)55-31-7-8(16(40)24(48)23(47)15(7)39)32(52-31)56-30-6-5(28(51-30)54-26)13(37)21(45)22(46)14(6)38;/q-2;+2
【InChIKey】
InChIKey=OFILAZNRYPZFNX-UHFFFAOYSA-N
【SMILES】
c1\2c(c(c(c(c1F)F)F)F)/c/3n/c-4n/c(n\c5c6c(c(c(c(c6F)F)F)F)c/7n5[Co]n3/c2n\c-8n/c(n7)/c9c8c(c(c(c9F)F)F)F)/c1c4c(c(c(c1F)F)F)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
COBALT(II) 1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-HEXADECAFLUORO-29H,31H-PHTHALOCYANINE.cml
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