Products 155613-98-2

CAS 155613-98-2 appears in our catalog under these names: 1-Butyl-2-[2-[3-[2-(1-butyl-6-chlorobenz[cd]indol-2(1H)-ylidene)ethylidene]-2-chloro-1-cyclohexen-1-yl]ethenyl]-6-chlorobenz[cd]indolium tetrafluoroborate, IR–1048, IR-1048, 97.0%, IR-1048 Dye content 97 %. Offered by: Chemat, GLPBio, MedChemExpress, Sigma-Aldrich. Available pack sizes: 100mg, 500mg, 10mg, 25mg, 5mg, 50mg, 5 mg, 10 mg.

1-Butyl-2-[2-[3-[2-(1-butyl-6-chlorobenz[cd]indol-2(1H)-ylidene)ethylidene]-2-chloro-1-cyclohexen-1-yl]ethenyl]-6-chlorobenz[cd]indolium tetrafluoroborate
Chemat
  • size: 100mg, 500mg
  • Variants: 2
from 1158.80
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IR–1048
GLPBio
  • size: 10mg, 25mg, 5mg, 50mg
  • Variants: 4
from 568.96
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IR-1048, 97.0%
MedChemExpress
  • size: 5 mg, 10 mg, 25 mg, 50 mg
  • Variants: 4
from 296.47
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IR-1048 Dye content 97 %
Sigma-Aldrich
  • size: 500MG
  • Variants: 1
from 1420.00
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Structural formula: {0} (CAS {1})

(2Z)-1-butyl-2-[(2E)-2-[3-[(E)-2-(1-butyl-6-chlorobenzo[cd]indol-1-ium-2-yl)ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-6-chlorobenzo[cd]indole tetrafluoroborate (CAS 155613-98-2) is a chemical compound with the molecular formula C40H38BCl3F4N2 and a molecular weight of 739.9 g/mol. IUPAC name: (2Z)-1-butyl-2-[(2E)-2-[3-[(E)-2-(1-butyl-6-chlorobenzo[cd]indol-1-ium-2-yl)ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-6-chlorobenzo[cd]indole tetrafluoroborate. InChIKey: IKZNCEDZIQWVNS-UHFFFAOYSA-N.

Identity
Molecular formulaC40H38BCl3F4N2
Molecular weight739.9 g/mol
IUPAC name(2Z)-1-butyl-2-[(2E)-2-[3-[(E)-2-(1-butyl-6-chlorobenzo[cd]indol-1-ium-2-yl)ethenyl]-2-chlorocyclohex-2-en-1-ylidene]ethylidene]-6-chlorobenzo[cd]indole tetrafluoroborate
InChIKeyIKZNCEDZIQWVNS-UHFFFAOYSA-N
SMILES[B-](F)(F)(F)F.CCCCN\1C2=C3C(=C(C=C2)Cl)C=CC=C3/C1=C/C=C/4\CCCC(=C4Cl)/C=C/C5=[N+](C6=C7C5=CC=CC7=C(C=C6)Cl)CCCC

Computed by PubChem (NCBI)