2-(2-(2-Chloro-3-(2-(1,1,3-trimethyl-1H-benzo[e]indol-2(3H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate

Catalog No. :: ACMJQF381
CAS No. :: 134127-48-3
Molecular Formula :: C47H47ClN2O3S
Molecular Weight :: 755.42

IUPAC Name:2-((E)-2-((E)-2-chloro-3-((E)-2-(1,1,3-trimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate

2-(2-(2-Chloro-3-(2-(1,1,3-trimethyl-1H-benzo[e]indol-2(3H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate structure diagram

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Product Information

Product Name	2-(2-(2-Chloro-3-(2-(1,1,3-trimethyl-1H-benzo[e]indol-2(3H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate
IUPAC Name	2-((E)-2-((E)-2-chloro-3-((E)-2-(1,1,3-trimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate
MDL No.	MFCD03093252
Molecular Formula	C47H47ClN2O3S
Molecular Weight	755.42
SMILES	C[N+]1=C(/C=C/C2=C(Cl)/C(CCC2)=C/C=C3N(C)C4=C(C5=CC=CC=C5C=C4)C/3(C)C)C(C)(C)C6=C1C=CC7=CC=CC=C67.O=S(C8=CC=C(C)C=C8)([O-])=O
InChI Key	LQVQHHTYXSPHSQ-UHFFFAOYSA-M
Synonym	134127-48-3 \| IR 813 (tosylate) \| 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 4-Methylbenzenesulfonate \| (2E)-2-[(2E)-2-[2-Chloro-3-[(E)-2-(1,1,3-trimethylb
CAS No.	134127-48-3
PubChem CID	44669077

Safety Data

Pictogram
Signal Word: Warning
Hazard Statement(s): H317-H319
Precautionary Statement(s): P280-P305+P351+P338

Synthetic Route by SureRoute

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2-(2-(2-Chloro-3-(2-(1,1,3-trimethyl-1H-benzo[e]indol-2(3H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate

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Synthetic Route by SureRoute

1. ACMJQF381 Molecular Building Block Synthetic Route

2. ACMJQF381 Molecular Building Block Synthetic Route

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2-(2-(2-Chloro-3-(2-(1,1,3-trimethyl-1H-benzo[e]indol-2(3H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,1,3-trimethyl-1H-benzo[e]indol-3-ium 4-methylbenzenesulfonate

Product Information

Safety Data

Synthetic Route by SureRoute

Sodium 2-(2-(2-chloro-3-(2-(1,3,3-trimethyl-5-sulfonatoindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,3,3-trimethyl-3H-indol-1-ium-5-sulfonate

2-(2-(2-Chloro-3-(2-(1,3,3-trimethylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,3,3-trimethyl-3H-indol-1-ium chloride

2-(2-(2-Chloro-3-(2-(1,3,3-trimethylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,3,3-trimethyl-3H-indol-1-ium iodide

2-[2-[2-Chloro-3-[(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethyl-3H-indolium tetrafluoroborate(1-)

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