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EC number: 215-524-7 | CAS number: 1328-53-6 This substance is identified in the Colour Index by Colour Index Constitution Number, C.I. 74260.
Reference substances
- IUPAC name:
- 14832-14-5
Inventory
- EC number:
- 238-897-8
- EC name:
- [1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]copper
- CAS number:
- 14832-14-5
- CAS number:
- 14832-14-5
Synonyms
- Names:
- Identifier:
- IUPAC name
- 3,4,5,6,12,13,14,15,21,22,23,24,30,31,32,33-hexadecachloro-9,18,27,36,37,39,40,41-octaaza-38-cupradecacyclo[17.17.3.1¹⁰,¹⁷.1²⁸,³⁵.0²,⁷.0⁸,³⁷.0¹¹,¹⁶.0²⁰,²⁵.0²⁶,³⁹.0²⁹,³⁴]hentetraconta-1,3,5,7,9,11(16),12,14,17(41),18,20(25),21,23,26,28(40),29(34),30,32,35-nonade
- Identifier:
- IUPAC name
- [1,2,3,4,8,9,10,11,15,16,17,18,22,23,24,25-hexadecachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]copper
- Identifier:
- IUPAC name
- [hexadecachloro-29H,31H-phthalocyaninato(2-)-N29,N30,N31,N32]copper
- Identifier:
- IUPAC name
- copper(2+) ion hexadecachloro-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.1³,¹⁰.1¹²,¹⁹.1²¹,²⁸.0⁴,⁹.0¹³,¹⁸.0²²,²⁷.0³¹,³⁶]tetraconta-1(36),2,4,6,8,10(40),11,13,15,17,19,21(38),22,24,26,28,30,32,34-nonadecaene-37,39-diide
- Identifier:
- other: SMILES notation
- ClC1=C(Cl)C(Cl)=C(Cl)C2=C1C3=NC2=NC4=C5C(=C6N=C7N=C(N=C8[N-]([Cu++][N-]46)C(=N3)C9=C8C(Cl)=C(Cl)C(Cl)=C9Cl)C%10=C7C(Cl)=C(Cl)C(Cl)=C%10Cl)C(Cl)=C(Cl)C(Cl)=C5Cl
- Identifier:
- other: SMILES notation
- ClC1=C(Cl)C2=C3\N=C\4/N=C(\N=C/5\c6c(Cl)c(Cl)c(Cl)c(Cl)c6\C\7=N\C8=N\C(=N/C(=C2C(=C1Cl)Cl)[N-]3[Cu+2][N-]57)\c9c(Cl)c(Cl)c(Cl)c(Cl)c89)c%10c(Cl)c(Cl)c(Cl)c(Cl)c4%10
- Identifier:
- other: SMILES notation
- Clc1c2c(c(Cl)c(Cl)c1Cl)C1=NC2=Nc2n3[Cu]N4C(=N1)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C4=NC1=NC(=Nc3c3c(Cl)c(Cl)c(Cl)c(Cl)c32)c2c1c(Cl)c(Cl)c(Cl)c2Cl
Molecular and structural information
- Molecular formula:
- C32Cl16CuN8
- Molecular weight:
- 1 127.2
- SMILES notation:
- ClC1=C(Cl)C(Cl)=C(Cl)C2=C1C1=N\C\2=N/C2=C3C(=C4\N=C5/N=C(/N=C6\N([Cu]N24)/C(=N\1)C1=C6C(Cl)=C(Cl)C(Cl)=C1Cl)C1=C5C(Cl)=C(Cl)C(Cl)=C1Cl)C(Cl)=C(Cl)C(Cl)=C3Cl
- InChl:
- InChI=1S/C32Cl16N8.Cu/c33-9-1-2(10(34)18(42)17(9)41)26-49-25(1)53-27-3-4(12(36)20(44)19(43)11(3)35)29(50-27)55-31-7-8(16(40)24(48)23(47)15(7)39)32(52-31)56-30-6-5(28(51-30)54-26)13(37)21(45)22(46)14(6)38;/q-2;+2
- Structural formula:
Related substances
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