ChemSpider 2D Image | 3-{4-[(1E,3E)-3-(1,3,3-Trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propen-1-yl]-1-quinoliniumyl}-1-propanesulfonatato(3-) | C26H28N2O3S

3-{4-[(1E,3E)-3-(1,3,3-Trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propen-1-yl]-1-quinoliniumyl}-1-propanesulfonatato(3-)

  • Molecular FormulaC26H28N2O3S
  • Average mass448.577 Da
  • Monoisotopic mass448.182068 Da
  • ChemSpider ID28639124

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

3-{4-[(1E,3E)-3-(1,3,3-Trimethyl-1,3-dihydro-2H-indol-2-yliden)-1-propen-1-yl]-1-chinoliniumyl}-1-propansulfonat [German] [ACD/IUPAC Name]
3-{4-[(1E,3E)-3-(1,3,3-Triméthyl-1,3-dihydro-2H-indol-2-ylidène)-1-propén-1-yl]-1-quinoléiniumyl}-1-propanesulfonate [French] [ACD/IUPAC Name]
3-{4-[(1E,3E)-3-(1,3,3-Trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propen-1-yl]-1-quinoliniumyl}-1-propanesulfonatato(3-) [ACD/IUPAC Name]
Quinolinium, 4-[(1E,3E)-3-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-1-(3-sulfopropyl)-, inner salt [ACD/Index Name]
1-(3-sulfopropyl)-4-[(1E,3E)-3-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)prop-1-en-1-yl]quinolinium
3-{4-[(1E,3E)-3-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)prop-1-en-1-yl]quinolinium-1-yl}propane-1-sulfonate
dimethylindole red
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:72811

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

FEMA No. 2364 [DBID]
  • Miscellaneous
    • Chemical Class:

      A fluorogenic cyanine dye in which <element>N</element>-(3-sulfopropyl)quinolinium is linked to a 1,3,3-trimethyldihydroindole via a propan-1-yl-3-ylidene chain to form a conjugated system. ChEBI CHEBI:72811
      A fluorogenic cyanine dye in which N-(3-sulfopropyl)quinolinium is linked to a 1,3,3-trimethyldihydroindole via a propan-1-yl-3-ylidene chain to form a conjugated system. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:72811

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 73 Å2
Polarizability:
Surface Tension:
Molar Volume:

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