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Reference substances

Currently viewing:
IUPAC name:
3,3'-(1,4-phenylenediimino)bis[4,5,6,7-tetrachloro-1H-isoindol-1-one]

Inventory

EC number:
226-999-5
EC name:
3,3'-(1,4-phenylenediimino)bis[4,5,6,7-tetrachloro-1H-isoindol-1-one]
CAS number:
5590-18-1
CAS number:
5590-18-1
Synonyms
Names:
1H-Isoindol-1-one, 3,3'-(1,4-phenylenediimino) bis[4,5,6,7-tetrachloro-
1H-Isoindol-1-one, 3,3'-(1,4-phenylenediimino)bis 4,5,6,7-tetrachloro-
1H-Isoindol-1-one, 3,3'-(1,4-phenylenediimino)bis[4,5,6,7-tetrachloro-
Identifier:
IUPAC name
3,3'-(1,4-phenylenediimino)bis[4,5,6,7-tetrachloro-1H-isoindol-1-one]
Identifier:
common name
Pigment Yellow 110
Identifier:
other: SMILES notation
C=1(c2c(c(c(Cl)c(Cl)c2C(=O)N1)Cl)Cl)Nc1ccc(cc1)NC1=NC(c2c1c(c(c(c2Cl)Cl)Cl)Cl)=O
Identifier:
other: SMILES notation
Clc1c(Cl)c(Cl)c2C(=NC(=O)c2c1Cl)Nc3ccc(NC4=NC(=O)c5c(Cl)c(Cl)c(Cl)c(Cl)c45)cc3
Identifier:
other: InChl
InChI=1/C22H6Cl8N4O2/c23-11-7-9(13(25)17(29)15(11)27)21(35)33-19(7)31-5-1-2-6(4-3-5)32-20-8-10(22(36)34-20)14(26)18(30)16(28)12(8)24/h1-4H,(H,31,33,35)(H,32,34,36)
3,3'-(1,4-phenylenediimino)bis(4,5,6,7-tetrachloro-1H-isoindol-1-one)

Molecular and structural information

Molecular formula:
C22H6Cl8N4O2
Molecular weight:
641.94
SMILES notation:
O=C(NC(=Nc(ccc(N=C(NC(=O)c1c(c(c(c2CL)CL)CL)CL)c12)c3)c3)c4c(c(c(c5CL)CL)CL)CL)c45
InChl:
1S/C22H6Cl8N4O2/c23-11-7-9(13(25)17(29)15(11)27)21(35)33-19(7)31-5-1-2-6(4-3-5)32-20-8-10(22(36)34-20)14(26)18(30)16(28)12(8)24/h1-4H,(H,31,33,35)(H,32,34,36)
Structural formula:
Chemical structure

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