2-Aminoazotoluene Hydrochloride - ≥98%(T) , CAS No.2298-13-7

CAS: 2298-13-7 Cat. No.: A151392 Molecular Weight: 261.75 EC Number: 218-945-4 PubChem CID: 16808

GRADE & PURITY ≥98%(T)

Synonyms

Azoene Fast Garnet GBCP Salt | Benzenamine, 2-methyl-4-(2-(2-methylphenyl)diazenyl)-, hydrochloride (1:1) | C.I. Solvent Yellow 3 monohydrochloride | FT-0617448 | C.I. Solvent Yellow 3, monohydrochloride | Hiltosal Fast Garnet GBC Salt | CCRIS 2429 | Diaz

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Azoene Fast Garnet GBCP Salt | Benzenamine, 2-methyl-4-(2-(2-methylphenyl)diazenyl)-, hydrochloride (1:1) | C.I. Solvent Yellow 3 monohydrochloride | FT-0617448 | C.I. Solvent Yellow 3, monohydrochloride | Hiltosal Fast Garnet GBC Salt | CCRIS 2429 | Diaz

Specifications & Purity

≥98%(T)

Storage

Room temperature

Shipped In

Normal

Purity

≥98%(T)

Names and Identifiers

• Pubchem Sid: 488182295
• Canonical Smiles: CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N)C.Cl
• IUPAC Name: 2-methyl-4-[(2-methylphenyl)diazenyl]aniline;hydrochloride
• InChIKey: PUDCZUQFOPHIGU-UHFFFAOYSA-N
• INCHI: 1S/C14H15N3.ClH/c1-10-5-3-4-6-14(10)17-16-12-7-8-13(15)11(2)9-12;/h3-9H,15H2,1-2H3;1H
• Isomeric SMILES: CC1=CC=CC=C1N=NC2=CC(=C(C=C2)N)C.Cl
• RTECS: BY6452000
• PubChem CID: 16808
• Molecular Weight: 261.75

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Azobenzenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Azobenzenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Azobenzenes
• Alternative Parents: Aniline and substituted anilines Aminotoluenes Azo compounds Propargyl-type 1,3-dipolar organic compounds Primary amines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Azobenzene - Aminotoluene - Aniline or substituted anilines - Toluene - Monocyclic benzene moiety - Benzenoid - Azo compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Hydrocarbon derivative - Organic nitrogen compound - Primary amine - Organonitrogen compound - Amine - Hydrochloride - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as azobenzenes. These are organonitrogen aromatic compounds that contain a central azo group, where each nitrogen atom is conjugated to a benzene ring.
• External Descriptors: Not available

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

Chemical and Physical Properties

• Melt Point(°C): >300℃
• Molecular Weight: 261.750 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 261.103 Da
• Monoisotopic Mass: 261.103 Da
• Topological Polar Surface Area: 50.700 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 264.000
• 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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