IR813

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Names

[ CAS No. ]:
134127-48-3

[ Name ]:
IR813

[Synonym ]:
EC 2117
2-(2-(2-Chloro-3-(2-(1,3-dihydro-1,1,3-trimethyl-2H-benzo[e]indole-2-ylidene)ethylidene)-1-cyclohexen-1-yl)ethenyl]-1]
ADS 830A
2-[2-[2-Chloro-3-[2-(1,3-dihydro-1,1,3-trimethyl-2H-benz[e]indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,1,3-trimethyl-1H-benz[e]indolium salt with 4-methylbenzenesulfonate (1:1)
2,6-DIMETHYLANILINE,[RING-14C(U)] HYDROCHLORIDE
IR DYE 813ABS
2-(2-(2-CHLORO-3-[2-(1,1,3-TRIMETHYL-2,3-DIHYDRO-1H-BENZO[E]INDOL-2-YLIDEN)ETHYLIDENE]-1-CYCLOHEXENYL)-1-ETHENYL)-1,1,3-TRIMETHYL-1H-BENZO[E]INDOLIUM 4-METHYL-1-BENZENESULFONATE
SDB 7047
2-[2-[2-CHLORO-3-[2-(1,3-DIHYDRO-1,1,3-TRIMETHYL-2H-BENZO[E]-INDOLE-2-YLIDENE)-ETHYLIDENE]-1-CYCLOHEXEN-1-YL]-ETHENYL]-1,1,3-TRIMETHYL-1H-BENZO[E]INDOLIUM 4-METHYLBENZENESULFONATE
IR813

Chemical & Physical Properties

[ Molecular Formula ]:
C47H47ClN2O3S

[ Molecular Weight ]:
755.40600

[ Exact Mass ]:
754.30000

[ PSA ]:
71.83000

[ LogP ]:
12.47360

MSDS

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Synthetic Route

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Precursor & DownStream

Precursor

  • 4-methylbenzenesulfonate,1,2,3,3-tetramethylbenzo[e]indol-3-ium
  • N-[(3-(Anilinomethylene)-2-chloro-1-cyclohexen-1-yl)methylene]aniline (hydrochloride)

DownStream

Related Compounds

  • 1-(Bromomethyl)-5-chloro-4-fluoro-2-(trifluoromethyl)benzene
  • Methyl (R)-5-amino-2-chloro-5,6,7,8-tetrahydronaphthalene-1-carboxylate hydrochloride
  • 2-Methyl-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-3-carboxylic acid
  • Methyl 6-chloro-3-hydroxy-1H-indole-2-carboxylate
  • 6-(Methylsulfinyl)-2,2'-bipyridine
  • (S)-1-(4-Chloro-2-methylphenyl)-2-methoxyethan-1-amine
  • (S)-2-(3-Chloro-4-methylphenyl)piperidine
  • (R)-2-(3-Fluoro-2-methylphenyl)-2-(methylamino)ethan-1-ol
  • (S)-6-Chloro-4-methyl-2,3-dihydro-1H-inden-1-amine
  • (S)-2-(3-Bromo-2-chlorophenyl)piperidine