2-Metil-3-nitroanilina - padrão analítico , CAS No.603-83-8

CAS: 603-83-8 Cat. No.: M106752 Fórmula: C₇H₈N₂O₂ Peso molecular: 152.15 Beilstein Registry Number: 388393 Número CE: 210-059-6

GRADE & PURITY Analytical standard

Synonyms

2-Metil-3-nitroanilina|603-83-8|2-Amino-6-nitrotolueno|3-NITRO-O-TOLUIDINA|Benzenamina, 2-metil-3-nitro-|2-metil-3-nitro-anilina|o-Toluidina, 3-nitro-|1-Amino-2-metil-3-nitrobenzeno|2-metil-3-nitrobenzenamina|D3JC433CEB|2-metil-3-nitro-fenilamina|D

Storage

Argon charged,Room temperature

Shipped In

Normal

Visão geral

o 2-Amino-6-nitrotolueno (2-Metil-3-nitroanilina) apresenta um comportamento voltamétrico de stripping que foi estudado utilizando um elétrodo de pasta de carbono modificado com C(18).

Specifications

Sinónimos

2-Metil-3-nitroanilina | 603-83-8 | 2-Amino-6-nitrotolueno | 3-NITRO-O-TOLUIDINA | Benzenamina, 2-metil-3-nitro- | 2-metil-3-nitro-anilina | o-Toluidina, 3-nitro- | 1-Amino-2-metil-3-nitrobenzeno | 2-metil-3-nitrobenzenamina | D3JC433CEB | 2-metil-3-nitro-fenilamina | D

Especificações e pureza

padrão analítico

Condições de armazenamento de armazenamento

Argon charged,Room temperature

Enviado em

Normal

Grau

Analytical standard

Nomes e identificadores

• Sorrisos canónicos: CC1=C(C=CC=C1[N+](=O)[O-])N
• IUPAC Name: 2-methyl-3-nitroaniline
• InChIKey: HFCFJYRLBAANKN-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O2/c1-5-6(8)3-2-4-7(5)9(10)11/h2-4H,8H2,1H3
• SMILES isoméricas: CC1=C(C=CC=C1[N+](=O)[O-])N
• WGK Alemanha: 3
• RTECS: XU8200000
• Número UN: 2660
• Grupo de embalagem: III
• Peso molecular: 152.15
• Beilstein: 388393
• Reaxy-Rn: 388393
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=388393&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Nitrobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Nitrobenzenes
• Alternative Parents: Nitrotoluenes Nitroaromatic compounds Aniline and substituted anilines Aminotoluenes Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Aminotoluene - Aniline or substituted anilines - Toluene - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Descrição: 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

Alvos associados (não humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)

Discover Target: Nfe2l2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Sensibilidade: Air Sensitive
• Ponto de ebulição (°C): 305°C
• Ponto de fusão (°C): 87-91°C
• Peso molecular: 152.150 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 152.059 Da
• Monoisotopic Mass: 152.059 Da
• Topological Polar Surface Area: 71.800 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 155.000
• 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

Referências

1. Zhenggong Wang, Huiting Ren, Shenxiang Zhang, Feng Zhang, Jian Jin.  (2018)  Carbon Molecular Sieve Membranes Derived from Tröger's Base-Based Microporous Polyimide for Gas Separation.  ChemSusChem,  11  (5): (916-923).  [PMID:29349873] [10.1002/cssc.201702243]

Perguntas frequentes

What does analytical standard mean?

analytical standard is a defined analytical purity tier suitable for quantitative analytical methods. It specifies a minimum assay percentage, controlled limits on common impurities (water, heavy metals, residue on ignition), and lot-to-lot consistency. analytical standard is one of several purity tiers — choose based on the sensitivity and regulatory requirements of your method.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 603-83-8, the molecular formula is C7H8N2O2, and the molecular weight is 152.15 g/mol. InChIKey HFCFJYRLBAANKN-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.