4-Nitrophenylhydrazine Hydrochloride - ≥98% , CAS No.636-99-7

CAS: 636-99-7 Cat. No.: N110268 Molecular Weight: 189.6 EC Number: 211-273-2

GRADE & PURITY ≥98%

Synonyms

A8763 | (4-nitrophenyl)hydrazine hydrochloride | ZWWXDCOPVYATOQ-UHFFFAOYSA-N | AMY11053 | (4-nitrophenyl)hydrazinehydrochloride | (4-nitrophenyl)diazane hydrochloride | NSC-231612 | 1-Hydrazino-4-nitrobenzene hydrochloride | p-Nitrophenylhydrazinhydrochlo

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

A8763 | (4-nitrophenyl)hydrazine hydrochloride | ZWWXDCOPVYATOQ-UHFFFAOYSA-N | AMY11053 | (4-nitrophenyl)hydrazinehydrochloride | (4-nitrophenyl)diazane hydrochloride | NSC-231612 | 1-Hydrazino-4-nitrobenzene hydrochloride | p-Nitrophenylhydrazinhydrochlo

Specifications & Purity

≥98%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488195564
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488195564
• Canonical Smiles: C1=CC(=CC=C1NN)[N+](=O)[O-].Cl
• IUPAC Name: (4-nitrophenyl)hydrazine;hydrochloride
• InChIKey: ZWWXDCOPVYATOQ-UHFFFAOYSA-N
• INCHI: 1S/C6H7N3O2.ClH/c7-8-5-1-3-6(4-2-5)9(10)11;/h1-4,8H,7H2;1H
• Isomeric SMILES: C1=CC(=CC=C1NN)[N+](=O)[O-].Cl
• Molecular Weight: 189.6
• Reaxy-Rn: 3569014
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3569014&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Nitrobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrobenzenes
• Alternative Parents: Phenylhydrazines Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Nitrobenzene - Nitroaromatic compound - Phenylhydrazine - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro 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: Solubility in Methanol almost transparency
• Sensitivity: Light sensitive;Moisture sensitive;Air sensitive
• Molecular Weight: 189.600 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 189.031 Da
• Monoisotopic Mass: 189.031 Da
• Topological Polar Surface Area: 83.900 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 137.000
• 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

References

1. Xiangyuan Zheng, Lan Luo, Jie Zhou, Xiaoling Ruan, Wenyuan Liu, Feng Zheng.  (2017)  Development and validation of a general derivatization HPLC method for the trace analysis of acyl chlorides in lipophilic drug substances.  JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS,      [PMID:28391005] [10.1016/j.jpba.2017.03.050]