Registration Dossier
Registration Dossier
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EC number: 249-300-5 | CAS number: 28901-96-4
Reference substances
- IUPAC name:
- [29H,31H-phthalocyaninato(2-)-kappa~2~N~29~,N~31~]copper
Inventory
- EC number:
- 205-685-1
- EC name:
- 29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32 copper
- CAS number:
- 147-14-8
- CAS number:
- 147-14-8
Synonyms
- Names:
- C.I. Pigment Blue 15 C.I.Pigment Blue 15 C.I. Pigment Blue 15:1 C.I. Pigment Blue 15:3 Copper, [29H,31H-phthalocyaninato( 2-)-N29,N30,N31,N32]-, (SP-4-1)- Copper, [29H,31H-phthalocyaninato(2-)-.kappa.N29,.kappa.N30,.kappa.N31,.kappa.N32]-, (SP-4-1)- [29H,31H-phthalocyaninato(2-)-kappa~2~N~29~,N~31~]copper [29H,31H-phthalocyaninato(2-)-κ4N29,N30,N31,N32]copper
- Identifier:
- IUPAC name
- 29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32 copper
- Identifier:
- other: InChl
- InChI=1S/C32H16N8.Cu/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2
- Identifier:
- other: SMILES notation
- [Cu]1N2\C3=N/C4=N/C(=N\C5=C6C=CC=CC6=C(\N=C6/N=C(/N=C2/C2=C3C=CC=C2)C2=C6C=CC=C2)N15)/C1=CC=CC=C41
Molecular and structural information
- Molecular formula:
- C32H16CuN8
- Molecular weight:
- 576.07
- SMILES notation:
- c1ccc2=C3N=C4c5ccccc5C6=N4[Cu+2]78[N-]3C(=c2c1)N=C9N7=C(c1c9cccc1)N=C1[N-]8C(=N6)c2c1cccc2
- InChl:
- 1S/C32H16N8.Cu/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+2
- Structural formula:
Related substances
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