2-Nitrophenylhydrazine - ≥97%, moistened with ≥ 30% water , CAS No.3034-19-3

CAS: 3034-19-3 Cat. No.: N104689 Molecular Weight: 153.14 Beilstein Registry Number: 512797 EC Number: 221-222-6

GRADE & PURITY ≥97%, moistened with ≥ 30% water

Synonyms

2-Nitrophenylhydrazine, 97% | Z104476396 | EN300-20011 | Hydrazine, (nitrophenyl)- | DTXSID30184423 | SCHEMBL297021 | HYDRAZINE, (o-NITROPHENYL)- | AKOS000200488 | o-NITROPHENYLHYDRAZINE | AB00443778-03 | FT-0613212 | N0413 | 1-(2-Nitrophenyl)hydrazine #

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice,FedEx DG Service

Specifications

Synonyms

2-Nitrophenylhydrazine, 97% | Z104476396 | EN300-20011 | Hydrazine, (nitrophenyl)- | DTXSID30184423 | SCHEMBL297021 | HYDRAZINE, (o-NITROPHENYL)- | AKOS000200488 | o-NITROPHENYLHYDRAZINE | AB00443778-03 | FT-0613212 | N0413 | 1-(2-Nitrophenyl)hydrazine #

Specifications & Purity

≥97%, moistened with ≥ 30% water

Storage

Store at 2-8°C, Protected from light

Shipped In

Wet ice, FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1=CC=C(C(=C1)NN)[N+](=O)[O-]
• IUPAC Name: (2-nitrophenyl)hydrazine
• InChIKey: FRBUNLLUASHNDJ-UHFFFAOYSA-N
• INCHI: 1S/C6H7N3O2/c7-8-5-3-1-2-4-6(5)9(10)11/h1-4,8H,7H2
• Isomeric SMILES: C1=CC=C(C(=C1)NN)[N+](=O)[O-]
• WGK Germany: 3
• UN Number: 1325
• Packing Group: II
• Molecular Weight: 153.14
• Beilstein: 512797
• Reaxy-Rn: 512797
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=512797&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 Organic zwitterions Organic oxides Hydrocarbon derivatives Hydrazines and 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 - Hydrazine derivative - Organic zwitterion - Organopnictogen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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

• Sensitivity: Light sensitive.
• Melt Point(°C): 90°C
• Molecular Weight: 153.140 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 153.054 Da
• Monoisotopic Mass: 153.054 Da
• Topological Polar Surface Area: 83.900 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 145.000
• 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

References

1. Shunli Ji, Hongbin Gao, Xingya Xia, Feng Zheng.  (2019)  A new HPLC-UV derivatization approach for the determination of potential genotoxic benzyl halides in drug substances.  RSC Advances,  9  (44): (25797-25804).  [PMID:35530063] [10.1039/C9RA03835C]

2. 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]