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- Copper(II) 1,4,8,11,15,18,22,25-octabutoxy-29H,31H-phthalocyanine - Dye content 95%, high purity , CAS No.107227-88-3
Copper(II) 1,4,8,11,15,18,22,25-octabutoxy-29H,31H-phthalocyanine - Dye content 95%, high purity , CAS No.107227-88-3
Basic Description
Specifications & Purity | Dye content 95% |
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Names and Identifiers
IUPAC Name | copper;5,8,14,17,23,26,32,35-octabutoxy-2,11,20,29,37,39-hexaza-38,40-diazanidanonacyclo[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-nonadecaene |
INCHI | InChI=1S/C64H80N8O8.Cu/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;/q-2;+2 |
InChi Key | GUXRYGQKVMJNDV-UHFFFAOYSA-N |
Canonical SMILES | CCCCOC1=C2C(=C(C=C1)OCCCC)C3=NC4=NC(=NC5=C6C(=CC=C(C6=C([N-]5)N=C7C8=C(C=CC(=C8C(=N7)N=C2[N-]3)OCCCC)OCCCC)OCCCC)OCCCC)C9=C(C=CC(=C94)OCCCC)OCCCC.[Cu+2] |
Isomeric SMILES | CCCCOC1=C2C(=C(C=C1)OCCCC)C3=NC4=NC(=NC5=C6C(=CC=C(C6=C([N-]5)N=C7C8=C(C=CC(=C8C(=N7)N=C2[N-]3)OCCCC)OCCCC)OCCCC)OCCCC)C9=C(C=CC(=C94)OCCCC)OCCCC.[Cu+2] |
PubChem CID | 5177118 |
Molecular Weight | 1152.91 |
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Chemical and Physical Properties
Flash Point(°F) | Not applicable |
Flash Point(°C) | Not applicable |
Melt Point(°C) | 184-187℃ (lit.) |
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Safety and Hazards(GHS)
RIDADR | NONH for all modes of transport |
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References
1. Naveen Rawat, Zhenwen Pan, Cody J Lamarche, Anthony Wetherby, Rory Waterman, Takahisa Tokumoto, Judy G Cherian, Randall L Headrick, Stephen A McGill, Madalina I Furis,. (2015-11-13) Spin Exchange Interaction in Substituted Copper Phthalocyanine Crystalline Thin Films.. Scientific reports, ( 16536-16536 ). [PMID:26559337] |
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