Products 116453-73-7

CAS 116453-73-7 appears in our catalog under these names: 1，4，8，11，15，18，22，25-Octabutoxy-29H，31H-phthalocyanine, 1,4,8,11,15,18,22,25-OCTABUTOXY-29H,31H&. Offered by: Chemat, Sigma-Aldrich. Available pack sizes: 250mg, 1G.

1，4，8，11，15，18，22，25-Octabutoxy-29H，31H-phthalocyanine
Chemat
  • size: 250mg
  • Variants: 1
from 1638.80
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1,4,8,11,15,18,22,25-OCTABUTOXY-29H,31H&
Sigma-Aldrich
  • size: 1G
  • Variants: 1
from 1630.00
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Structural formula: {0} (CAS {1})

5,8,14,17,23,26,32,35-octabutoxy-2,11,20,29,37,38,39,40-octazanonacyclo[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 (CAS 116453-73-7) is a chemical compound with the molecular formula C64H82N8O8 and a molecular weight of 1091.4 g/mol. IUPAC name: 5,8,14,17,23,26,32,35-octabutoxy-2,11,20,29,37,38,39,40-octazanonacyclo[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. InChIKey: KAPOSTKECKHKAP-UHFFFAOYSA-N.

Identity
Molecular formulaC64H82N8O8
Molecular weight1091.4 g/mol
IUPAC name5,8,14,17,23,26,32,35-octabutoxy-2,11,20,29,37,38,39,40-octazanonacyclo[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
InChIKeyKAPOSTKECKHKAP-UHFFFAOYSA-N
SMILESCCCCOC1=C2C(=C(C=C1)OCCCC)C3=NC4=NC(=NC5=C6C(=CC=C(C6=C(N5)N=C7C8=C(C=CC(=C8C(=N7)N=C2N3)OCCCC)OCCCC)OCCCC)OCCCC)C9=C(C=CC(=C94)OCCCC)OCCCC

Computed by PubChem (NCBI)

Synonyms: H2Pc(Obu)8, 1,4,8,11,15,18,22,25-Octa-n-butoxyphthalocyanine, 1,4,8,11,15,18,22,25-octabutoxyphthalocyanine, 1,4,8,11,15,18,22,25-Octabutoxy-phthalocyanine, 1,4,8,11,15,18,22,25-Octabutoxy-29H,31H-phthalocyanine, Dye content 95 %