Neutral red indicator - 0.1% , CAS No.553-24-2

CAS: 553-24-2 Cat. No.: N299163 Summenformel: C₁₅H₁₇CIN₄ Molekulargewicht: 288.78 EG-Nummer: 209-035-8

QUALITÄT & REINHEIT 0.1%

Synonyms

EINECS 209-035-8 | Phenazine, 3-amino-7-(dimethylamino)-2-methyl-, hydrochloride | NEUTRAL RED | C.I. 50040 | NeutralRed | AI3-60242 | HY-D0166A | N0315 | N-2527 | C.I. Basic Red 5, monohydrochloride (VAN) | Michrome No. 226 | N0112 | C15H17N4Cl | Neutral

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

EINECS 209-035-8 | Phenazine, 3-amino-7-(dimethylamino)-2-methyl-, hydrochloride | NEUTRAL RED | C.I. 50040 | NeutralRed | AI3-60242 | HY-D0166A | N0315 | N-2527 | C.I. Basic Red 5, monohydrochloride (VAN) | Michrome No. 226 | N0112 | C15H17N4Cl | Neutral

Spezifikationen & Reinheit

0.1%

Storage

Room temperature

Verschickt in

Normal

Namen und Kennungen

Pubchem Sid

528769272

Kanonisches Lächeln

CC1=CC2=NC3=C(C=C(C=C3)N(C)C)N=C2C=C1N.Cl

IUPAC Name

8-N,8-N,3-trimethylphenazine-2,8-diamine;hydrochloride

InChIKey

PGSADBUBUOPOJS-UHFFFAOYSA-N

INCHI

1S/C15H16N4.ClH/c1-9-6-13-15(8-11(9)16)18-14-7-10(19(2)3)4-5-12(14)17-13;/h4-8H,16H2,1-3H3;1H

Isomere SMILES

CC1=CC2=NC3=C(C=C(C=C3)N(C)C)N=C2C=C1N.Cl

Molekulargewicht

288.78

Reaxy-Rn

3918740

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3918740&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Diazanaphthalenes
      • Subclass Benzodiazines
        • Ebene5 Quinoxalines
          • Ebene6 Phenazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Quinoxalines
• Direct Parent: Phenazines and derivatives
• Alternative Parents: Dialkylarylamines Pyrazines Benzenoids Heteroaromatic compounds Azacyclic compounds Primary amines Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Phenazine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Pyrazine - Benzenoid - Heteroaromatic compound - Tertiary amine - Azacycle - Amine - Hydrocarbon derivative - Organopnictogen compound - Primary amine - Organic nitrogen compound - Organonitrogen compound - Hydrochloride - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as phenazines and derivatives. These are polycyclic aromatic compounds containing a phenazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a pyrazine ring.
• External Descriptors: hydrochloride

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.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 290°C
• Molekulargewicht: 288.770 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 288.114 Da
• Monoisotopic Mass: 288.114 Da
• Topological Polar Surface Area: 55.000 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 319.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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