430994

Zinc 2,9,16,23-tetra-tert-butyl-29H,31H-phthalocyanine

Dye content ~96 %

• Empirical Formula (Hill Notation): C₄₈H₄₈N₈Zn
• CAS Number: 39001-65-5
• Molecular Weight: 802.34
• NACRES: NA.23
• PubChem Substance ID: 24866957
• UNSPSC Code: 12352103
• MDL number: MFCD00209626

Properties

• composition: Dye content, ~96%
• mp: >300 °C (lit.)
• λmax: 677 nm
• SMILES string: CC(C)(C)c1ccc2c3nc(nc4n5[Zn]n6c(nc7nc(nc5c8cc(ccc48)C(C)(C)C)c9ccc(cc79)C(C)(C)C)c%10ccc(cc%10c6n3)C(C)(C)C)c2c1
• InChI: 1S/C48H48N8.Zn/c1-45(2,3)25-13-17-29-33(21-25)41-49-37(29)54-42-35-23-27(47(7,8)9)15-19-31(35)39(51-42)56-44-36-24-28(48(10,11)12)16-20-32(36)40(52-44)55-43-34-22-26(46(4,5)6)14-18-30(34)38(50-43)53-41;/h13-24H,1-12H3;/q-2;+2
• InChI key: XWOSAEWCOSVNDP-UHFFFAOYSA-N

Description

Safety Information

• Storage Class: 13 - Non Combustible Solids
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable