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· · COA & SDS available for every product · Same-day shipping on in-stock items Pseudoisocyanine , CAS No.20766-49-8
Synonyms
Pseudoisocyanine | 1,1'-Diethyl-2,2'-cyanine | CHEBI:37994 | (2E)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline | 1-Ethyl-2-[(1E)-(1-ethyl-2(1H)-quinolinylidene)methyl]quinolinium | 1-ethyl-2-[(E)-(1-ethylquinolin-2(1H)-ylidene)methyl]quino
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Why this grade for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature Ships Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
Pseudoisocyanine | 1, 1'-Diethyl-2, 2'-cyanine | CHEBI:37994 | (2E)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline | 1-Ethyl-2-[(1E)-(1-ethyl-2(1H)-quinolinylidene)methyl]quinolinium | 1-ethyl-2-[(E)-(1-ethylquinolin-2(1H)-ylidene)methyl]quino
Product Properties Names and Identifiers Canonical Smiles CCN1C(=CC2=[N+](C3=CC=CC=C3C=C2)CC)C=CC4=CC=CC=C41 IUPAC Name (2E)-1-ethyl-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]quinoline InChIKey AGJZCWVTGOVGBS-UHFFFAOYSA-N INCHI 1S/C23H23N2/c1-3-24-20(15-13-18-9-5-7-11-22(18)24)17-21-16-14-19-10-6-8-12-23(19)25(21)4-2/h5-17H,3-4H2,1-2H3/q+1 Isomeric SMILES CCN1/C(=C/C2=[N+](C3=CC=CC=C3C=C2)CC)/C=CC4=CC=CC=C41 Molecular Weight 327.4 Reaxy-Rn 4156095 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4156095&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Class Quinolines and derivatives Subclass Quinolones and derivatives Intermediate Tree Nodes Not available Direct Parent Hydroquinolones Alternative Parents Hydroquinolines Tertiary alkylarylamines Pyridinium derivatives Benzenoids Heteroaromatic compounds Enamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives Organic cations Molecular Framework Aromatic heteropolycyclic compounds Substituents Dihydroquinolone - Dihydroquinoline - Tertiary aliphatic/aromatic amine - Benzenoid - Pyridinium - Pyridine - Heteroaromatic compound - Tertiary amine - Azacycle - Enamine - Amine - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as hydroquinolones. These are compounds containing a hydrogenated quinoline bearing a ketone group. External Descriptors quinolines Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Molecular Weight 327.400 g/mol XLogP3 5.600 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 1 Rotatable Bond Count 3 Exact Mass 327.186 Da Monoisotopic Mass 327.186 Da Topological Polar Surface Area 7.100 Ų Heavy Atom Count 25 Formal Charge 1 Complexity 464.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 1 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 1 Covalently-Bonded Unit Count 1
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