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

CAS: 553-24-2 Cat. No.: N299163 Formula: C₁₅H₁₇CIN₄ Peso molecolare: 288.78 Numero EC: 209-035-8

QUALITÀ & PUREZZA 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

Specifiche

Sinonimi

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

Specifiche e purezza

0.1%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Nomi e identificatori

Pubchem Sid

528769272

Sorrisi canonici

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

Isomeri SMILES

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

Peso molecolare

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
    • Classe Diazanaphthalenes
      • Subclass Benzodiazines
        • Level5 Quinoxalines
          • Level6 Phenazines and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: 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
• Descrizione: 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

Proprietà chimiche e fisiche

• Punto di fusione (°C): 290°C
• Peso molecolare: 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

XLogP3