EINECS 270-370-8 structure

EINECS 270-370-8

copper 6,7,15,16,24,25,32,33,34-nonabromo-8,26-dichloro-2,11,20,37,38,39-hexaza-29,40-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(38),30(37),31,33,35-nonadecaene

Also Known As: copper;5,6,7,15,16,24,25,33,34-nonabromo-17,35-dichloro-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|1,2,3,9,10,16,17,23,24-Nonabromo-11,25-dichloro-29H,31H-phthalocyanine|(1,2,3,9,10,16,17,23,24-Nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32)copper|[1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]copper|Copper, (1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-kappaN29,kappaN30,kappaN31,kappaN32)-, (SP-4-2)-|Copper, (1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-N29,N39,N31,N32)-, (SP-4-2)-|Copper, [1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-.kappa.N29,.kappa.N30,.kappa.N31,.kappa.N32]-, (SP-4-2)-|Copper(2+) 2,3,4,9,10,16,17,23,24-nonabromo-8,22-dichlorophthalocyanine-6,30-diide|[1,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29h,31h-phthalocyaninato]-(sp-4-2)-copper|270-370-8|Copper,[1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-kN29,kN30,kN31,kN32]-, (SP-4-2)-|Copper,[1,2,3,9,10,16,17,23,24-nonabromo-11,25-dichloro-29H,31H-phthalocyaninato(2-)-kn29,kn30,kn31,kn32]-,(sp-4-2)-

CAS: 68425-85-4
Molecular Formula C32H5Br9Cl2CuN8
Molecular Weight 1344.196 g/mol
LogP 14.1974
Topological Polar Surface Area 79.3 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 0
Exact Mass 1344.196
Monoisotopic Mass 1344.196
Heavy Atoms 52
Complexity 1310.0

Chemical Identifiers

CAS Number 68425-85-4
SMILES C1=C2C(=CC(=C1Br)Br)C3=NC2=NC4=C5C(=C([N-]4)N=C6C7=CC(=C(C(=C7C(=N6)[N-]C8=NC(=N3)C9=CC(=C(C(=C98)Cl)Br)Br)Br)Br)Br)C=C(C(=C5Cl)Br)Br.[Cu+2]
InChIKey OSPDVUVHHYFQBY-UHFFFAOYSA-N

Product Overview

EINECS 270-370-8 (CAS 68425-85-4), with molecular formula C32H5Br9Cl2CuN8 and molecular weight 1344.196 g/mol. IUPAC: copper 6,7,15,16,24,25,32,33,34-nonabromo-8,26-dichloro-2,11,20,37,38,39-hexaza-29,40-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(38),30(37),31,33,35-nonadecaene.

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