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Reference substances

Reference substances

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General information

Inventory

EC number:
226-106-9
EC name:
N,N'-(2-chloro-1,4-phenylene)bis[4-[(2,5-dichlorophenyl)azo]-3-hydroxynaphthalene-2-carboxamide]
CAS number:
5280-78-4

No inventory information available

Reference substance information

IUPAC name:
N-(3-chloro-4-{4-[(E)-2-(2,5-dichlorophenyl)diazen-1-yl]-3-hydroxynaphthalene-2-amido}phenyl)-4-[(E)-2-(2,5-dichlorophenyl)diazen-1-yl]-3-hydroxynaphthalene-2-carboxamide
Synonyms
Names:
2-Naphthalenecarboxamide, N,N'-(2-chloro-1,4-phenylene) bis[4-[(2,5-dichlorophenyl)azo]-3-hydroxy-
2-Naphthalenecarboxamide, N,N'-(2-chloro-1,4-phenylene)bis(4-((2,5-dichlorophenyl)azo)-3-hydroxy-
2-Naphthalenecarboxamide, N,N'-(2-chloro-1,4-phenylene)bis[4-[(2,5-dichlorophenyl)azo]-3-hydroxy-
Identifier:
CAS number
5280-78-4
Identifier:
other: InChl
InChI=1S/C40H23Cl5N6O4/c41-22-9-12-29(43)33(17-22)48-50-35-25-7-3-1-5-20(25)15-27(37(35)52)39(54)46-24-11-14-32(31(45)19-24)47-40(55)28-16-21-6-2-4-8-26(21)36(38(28)53)51-49-34-18-23(42)10-13-30(34)44/h1-19,52-53H,(H,46,54)(H,47,55)/b50-48+,51-49+
Identifier:
other: SMILES notation
Oc1c(cc2ccccc2c1\N=N\c1cc(Cl)ccc1Cl)C(=O)Nc1ccc(NC(=O)c2cc3ccccc3c(\N=N\c3cc(Cl)ccc3Cl)c2O)c(Cl)c1
N,N'-(2-chloro-1,4-phenylene)bis{4-[(2,5-dichlorophenyl)diazenyl]-3-hydroxy-2-naphthamide}

CAS information

CAS number:
5280-78-4

Molecular and structural information

Molecular formula:
C40H23Cl5N6O4
Molecular weight:
828.913
SMILES notation:
Clc7ccc(Cl)cc7N=Nc5c6ccccc6cc(C(=O)Nc4ccc(NC(=O)c3cc1ccccc1c(N=Nc2cc(Cl)ccc2Cl)c3O)cc4Cl)c5O
InChl:
InChI=1/C40H23Cl5N6O4/c41-22-9-12-29(43)33(17-22)48-50-35-25-7-3-1-5-20(25)15-27(37(35)52)39(54)46-24-11-14-32(31(45)19-24)47-40(55)28-16-21-6-2-4-8-26(21)36(38(28)53)51-49-34-18-23(42)10-13-30(34)44/h1-19,52-53H,(H,46,54)(H,47,55)
Structural formula:
Chemical structure