(3Z)-5-({4-Chloro-6-[Methyl(Phenyl)Amino]-1,3,5-Triazin-2-Yl}Amino)-3-[(4-Methyl-2-Sulfophenyl)Hydrazono]-4-Oxo-3,4-Dihydro-2,7-Naphthalenedisulfonic Acid

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Properties Simple | Detailed

Formula C27H22ClN7O10S3
IUPAC Name (3z)-5-[[4-chloro-6-(n-methylanilino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid
Molecular Mass 736.152 g·mol−1
Heat of Formation -1056.9 ± 16.7 kJ·mol−1
Dipole Moment 7.99 ± 1.08 D
Volume 718.81 Å 3
Surface Area 594.3 Å 2
HOMO Energy -8.96 ± 0.55 eV
LUMO Energy -2.53 ± eV
Point Group Symmetry C1
Synonyms
  • (3z)-5-[[4-chloro-6-(methyl-phenyl-amino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfo-phenyl)hydrazinylidene]-4-oxo-naphthalene-2,7-disulfonic acid
  • (3z)-5-[[4-chloro-6-(methyl-phenyl-amino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfo-phenyl)hydrazono]-4-oxo-naphthalene-2,7-disulfonic acid
  • (3z)-5-[[4-chloro-6-(methyl-phenyl-amino)-s-triazin-2-yl]amino]-4-keto-3-[(4-methyl-2-sulfo-phenyl)hydrazono]naphthalene-2,7-disulfonic acid
  • (3z)-5-[[4-chloro-6-(methyl-phenylamino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfophenyl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid
  • (3z)-5-[[4-chloro-6-(methyl-phenylamino)-1,3,5-triazin-2-yl]amino]-3-[(4-methyl-2-sulfophenyl)hydrazono]-4-oxonaphthalene-2,7-disulfonic acid
  • 2,7-naphthalenedisulfonic acid, 5-((4-chloro-6-(methylphenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-2-sulfophenyl)azo)-
  • 5-((4-chloro-6-phenylamino-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methyl-6-sulfophenyl)azo)-2,7-naphthalenedisulfonic acid
  • ads j2
CAS Number(s)
  • 73287-61-3
InChIKey MFKILSGXTOAURQ-PPFNPFNJSA-N
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