CAS 134127-48-3: 1H-Benz[e]indolium, 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-, 4-methylbenzenesulfonate (1:1)

Description: 1H-Benz[e]indolium, 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-, 4-methylbenzenesulfonate (1:1), with CAS number 134127-48-3, is a complex organic compound characterized by its intricate molecular structure, which includes multiple aromatic rings and functional groups. This substance typically exhibits properties associated with organic dyes or pigments, such as vibrant coloration and potential applications in photonic devices or as a fluorescent marker. The presence of the sulfonate group suggests it may possess good solubility in polar solvents, enhancing its utility in various chemical environments. Additionally, the chlorinated and cyclohexenyl components may impart unique reactivity and stability characteristics, making it suitable for specific synthetic applications. Its structural features indicate potential biological activity, which could be explored in medicinal chemistry. Overall, this compound exemplifies the diversity of organic chemistry and the potential for novel applications in materials science and biochemistry.

Formula: C₄₀H₄₀ClN₂·C₇H₇O₃S

InChI: InChI=1S/C40H40ClN2.C7H8O3S/c1-39(2)34(42(5)32-22-18-26-12-7-9-16-30(26)36(32)39)24-20-28-14-11-15-29(38(28)41)21-25-35-40(3,4)37-31-17-10-8-13-27(31)19-23-33(37)43(35)6;1-6-2-4-7(5-3-6)11(8,9)10/h7-10,12-13,16-25H,11,14-15H2,1-6H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChI key: InChIKey=LQVQHHTYXSPHSQ-UHFFFAOYSA-M

SMILES: O=S(=O)([O-])C1=CC=C(C=C1)C.ClC=1C(=CC=C2N(C=3C=CC=4C=CC=CC4C3C2(C)C)C)CCCC1C=CC5=[N+](C=6C=CC=7C=CC=CC7C6C5(C)C)C

Synonyms:

• 1H-Benz[e]indolium, 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-, 4-methylbenzenesulfonate (1:1)
• 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]
• 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
• 2-[(E)-2-{(3E)-2-Chloro-3-[(2E)-2-(1,1,3-Trimethyl-1,3-Dihydro-2H-Benzo[E]Indol-2-Ylidene)Ethylidene]Cyclohex-1-En-1-Yl}Ethenyl]-1,1,3-Trimethyl-1H-Benzo[E]Indolium 4-Methylbenzenesulfonate
• 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
• Adagio
• Ads 830A
• Ads 830At
• C 2886
• Ec 2117
• IR 813 Tosylate
• IR Dye 23b
• IR Dye 813Abs
• Kf 1151
• Lf Nird 010
• Nird 010
• Nk 4680
• Pina-Kf 1151
• S 0094
• Sdb 7047
• St 798
• Trump Dye
• Trump IR
• Trump IR dye
• 1H-Benz[e]indolium, 2-[2-[2-chloro-3-[(1,3-dihydro-1,1,3-trimethyl-2H-benz[e]indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,1,3-trimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)

IR-813 p-Toluenesulfonate

CAS: 134127-48-3

• Formula: C₄₇H₄₇ClN₂O₃S
• Purity: >98.0%(HPLC)
• Color and Shape: Orange to Brown to Dark purple powder to crystal
• Molecular weight: 755.41

1H-Benz[e]indolium,2-[2-[2-chloro-3-[(1,3-dihydro-1,1,3-trimethyl-2H-benz[e]indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,1,3-trimethyl-, salt with4-methylbenzenesulfonic acid (1:1)

CAS: 134127-48-3

• Formula: C₄₇H₄₇ClN₂O₃S
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 755.4056800000004

Ir-813 P-Toluenesulfonate

CAS: 134127-48-3

• Purity: 98%
• Molecular weight: 755.41g/mol

IR 813 tosylate

CAS: 134127-48-3

IR 813 tosylate is a near-infrared (NIR) fluorescent dye with excitation and emission wavelengths of …

• Formula: C₄₇H₄₇ClN₂O₃S
• Color and Shape: Liquid
• Molecular weight: 755.41

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

CAS: 134127-48-3

The enhancement of the fluorescence of 2-(2-{2-chloro-3-[2-(1,1,3-trimethyl-2,3-dihydro-1H-benzo[e]indol-2-yliden)ethylidene]-1cyclohexenyl}1ethenyl)-1,1,3-trimethyl -1H-benzo[e]indolium 4methyl 1benzenesulfonate (TOF) by a low energy …

• Formula: C₄₇H₄₇N₂SO₃Cl
• Purity: Min. 95%
• Color and Shape: Yellow Red To Red To Purple Solid
• Molecular weight: 755.41 g/mol