1,4,8,11,15,18,22,25-OCTABUTOXY-29H,31H-PHTHALOCYANINE

CAS No.
116453-73-7
CCD No.
CCD00065087
Formula
C64 H82 N8 O8
MolWeight
1091.4

Basic Information

Product Name: 1,4,8,11,15,18,22,25-OCTABUTOXY-29H,31H-PHTHALOCYANINE
CAS: 116453-73-7
English Synonyms: 1,4,8,11,15,18,22,25-OCTABUTOXY-29H,31H-PHTHALOCYANINE
MDL Number.: MFCD00134589
H bond acceptor: 16
H bond donor: 2
Smile: CCCCOc1ccc(c\2c1/c3/[nH]/c2n\c-4n/c(n\c5c6c(ccc(c6c([nH]5)/nc/7\nc(\n3)-c8c7c(ccc8OCCCC)OCCCC)OCCCC)OCCCC)/c9c4c(ccc9OCCCC)OCCCC)OCCCC
InChi: InChI=1S/C64H82N8O8/c1-9-17-33-73-41-25-26-42(74-34-18-10-2)50-49(41)57-65-58(50)70-60-53-45(77-37-21-13-5)29-30-46(78-38-22-14-6)54(53)62(67-60)72-64-56-48(80-40-24-16-8)32-31-47(79-39-23-15-7)55(56)63(68-64)71-61-52-44(76-36-20-12-4)28-27-43(75-35-19-11-3)51(52)59(66-61)69-57/h25-32H,9-24,33-40H2,1-8H3,(H2,65,66,67,68,69,70,71,72)
InChiKey: InChIKey=KAPOSTKECKHKAP-UHFFFAOYSA-N

Property

Melting Point: 221 DEG C (DEC)(LIT)
Comments: COMPOSITION: DYE CONTENT, 95%
UNSPSC: 12171500
UV ABSORPTION: LAMBDAMAX 762 NM
WGK: 3

Safety information

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