2,4,6-Trichlorophenylhydrazine - ≥98% , CAS No.5329-12-4

CAS: 5329-12-4 Cat. No.: T101287 Molecular Weight: 211.48 Beilstein Registry Number: 1841962 EC Number: 226-217-2 PubChem CID: 79234

GRADE & PURITY ≥98%

Synonyms

(2,4,6-trichlorophenyl)-|2,4,6-trichlorophenyl hydrazine|3ARF2RVG9W|NSC-1869|1-(2,4,6-Trichlorophenyl)hydrazine|UNII-3ARF2RVG9W|2,4,6 trichlorophenylhydrazine | (2,4,6-Trichlorophenyl)hydrazine|Hydrazine

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

(2, 4, 6-trichlorophenyl)- | 2, 4, 6-trichlorophenyl hydrazine | 3ARF2RVG9W | NSC-1869 | 1-(2, 4, 6-Trichlorophenyl)hydrazine | UNII-3ARF2RVG9W | 2, 4, 6 trichlorophenylhydrazine | (2, 4, 6-Trichlorophenyl)hydrazine | Hydrazine

Specifications & Purity

≥98%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Canonical Smiles: C1=C(C=C(C(=C1Cl)NN)Cl)Cl
• IUPAC Name: (2,4,6-trichlorophenyl)hydrazine
• InChIKey: MULHANRBCQBHII-UHFFFAOYSA-N
• INCHI: 1S/C6H5Cl3N2/c7-3-1-4(8)6(11-10)5(9)2-3/h1-2,11H,10H2
• Isomeric SMILES: C1=C(C=C(C(=C1Cl)NN)Cl)Cl
• WGK Germany: 3
• PubChem CID: 79234
• Molecular Weight: 211.48
• Beilstein: 1841962

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Benzene and substituted derivatives
      • Subclass Phenylhydrazines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Phenylhydrazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylhydrazines
• Alternative Parents: Chlorobenzenes Aryl chlorides Organopnictogen compounds Organochlorides Hydrocarbon derivatives Hydrazines and derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylhydrazine - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrazine derivative - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as phenylhydrazines. These are compounds containing a phenylhydrazide moiety, which consists of a hydrazide substituent attached to a phenyl group.
• 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

• Solubility: Soluble in acetone. Insoluble in water.
• Sensitivity: Air sensitive
• Melt Point(°C): 142-143°C
• Molecular Weight: 211.500 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 209.952 Da
• Monoisotopic Mass: 209.952 Da
• Topological Polar Surface Area: 38.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 121.000
• 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: 1

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