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2-Amino-3-nitrobenzoic acid

Unit Price: Get Latest Price
CAS No.:

606-18-8

Grade:

Pharmaceutical Grade

Packaging:

25kg/Cardboard Drum

Price valid (until):

2025-04-30

Company Type:
Manufactory
Location:
China
Qualification:
Main Products:

Agrochemicals,Daily Chemicals,Catalysts & Chemical Auxiliary Agents,Extract,Inorganic Chemicals,Organic Intermediate

  • Product Description

  • Seller Information

  • Description


      Product Detail  


    2-Amino-3-nitrobenzoic Acid (CAS 606-18-8): Multifunctional Chemical Intermediate

    Molecular Architecture Analysis

    2-Amino-3-nitrobenzoic acid (C7H6N2O4), a structurally complex aromatic compound, features three distinct functional groups strategically positioned on its benzene ring. The carboxylic acid group at position 1 creates strong electron-withdrawing effects, while the adjacent amino (NH2) and nitro (NO2) groups at positions 2 and 3 respectively create unique electronic conjugation patterns. This molecular configuration enables 2-Amino-3-nitrobenzoic acid to participate in various chemical reactions including electrophilic substitution, nucleophilic addition, and redox processes.

    Crystallographic Properties

    Single-crystal X-ray diffraction studies reveal monoclinic crystal system with space group P21/c. Unit cell parameters: a = 7.892 Å, b = 5.432 Å, c = 12.765 Å, β = 97.8°. The molecular packing diagram shows intermolecular hydrogen bonding between carboxylic oxygen and amino hydrogen atoms (O…H distance 1.85 Å).

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    Extended Physicochemical Profile

    Parameter Value Test Method
    Density 1.612 g/cm³ ASTM D4052
    Refractive Index 1.657 ASTM D1218
    Flash Point >250°C ISO 3679
    Vapor Pressure 2.3×10-7 mmHg @25°C OECD 104
    Dielectric Constant 3.82 ASTM D150


    Advanced Synthetic Chemistry

    Industrial-Scale Production

    Modern manufacturing utilizes continuous flow reactor technology for improved safety and yield:

    1. Precision nitration: Mixed acid (HNO3/H2SO4 1:3 v/v) at 5±0.5°C
    2. Residence time optimization: 45 minutes with turbulent flow (Re >4000)
    3. In-situ neutralization: Automated pH control (5.8-6.2) using NaOH solution
    4. Crystallization: Anti-solvent precipitation with ethanol/water (3:7 ratio)

    Quality Control Protocols

    • HPLC Analysis: C18 column (4.6×250mm), mobile phase ACN/0.1% H3PO4 (35:65)
    • FTIR Verification: Characteristic peaks at 1685 cm-1 (C=O), 1530 cm-1 (NO2)
    • TGA Monitoring: 5% weight loss at 205°C (dehydration), major decomposition @315°C

    Cross-Industry Applications

    Advanced Pharmaceutical Development

    As crucial intermediate in:

    • Antimycobacterial agents: Core structure in BTZ043 derivatives (Phase III clinical trials)
    • Kinase inhibitors: Chelating moiety in EGFR-T790M inhibitors
    • Proteolysis-targeting chimeras (PROTACs): Linker component for E3 ligase recruitment

    Next-Gen Material Science

    • Metal-Organic Frameworks (MOFs): Building block for gas-selective porous materials
    • Conductive polymers: Dopant for polyaniline-based supercapacitors
    • Liquid crystal composites: Hydrogen-bonded mesogens with tunable phase transitions


    Technical Support Documents

    Document Version Availability
    Material Safety Data Sheet 4.3 PDF Download
    Stability Summary 2024.1 Upon Request
    Regulatory Compliance REACH/TSG Online Access

    Basic Info
    Product Name:

    2-Amino-3-nitrobenzoic acid

    Other Name:

    Benzoic acid,2-amino-3-nitro-;Anthranilic acid,3-nitro-;2-Amino-3-nitrobenzoic acid;3-Nitroanthranilic acid;NSC 1162

    CAS No.:

    606-18-8

    Molecular Formula:

    C7H6N2O4

    InChIKeys:

    InChIKey=JJPIVRWTAGQTPQ-UHFFFAOYSA-N

    Molecular Weight:

    182.13

    Exact Mass:

    182.13

    NSC Number:

    1162

    DSSTox ID:

    DTXSID60277211

    HScode:

    2922499990

    Characteristics
    PSA:

    109

    XLogP3:

    1.1

    Appearance:

    WHITE TO BROWN SOLID, POWDER, CRYSTALS, CRYSTALLINE POWDER, AND/OR CHUNKS

    Density:

    1.6±0.1 g/cm3

    Melting Point:

    208-209 °C

    Boiling Point:

    390.4°C at 760 mmHg

    Flash Point:

    189.9±25.1 °C

    Refractive Index:

    1.682

    Storage Conditions:

    Refrigerator

    Hazard Identification

    Classification of the substance or mixture

    Acute toxicity - Category 4, Oral

    GHS label elements, including precautionary statements

    Pictogram(s)
    Signal word

    Warning

    Hazard statement(s)

    H302 Harmful if swallowed

    Precautionary statement(s)
    Prevention

    P264 Wash ... thoroughly after handling.

    P270 Do not eat, drink or smoke when using this product.

    Response

    P301+P317 IF SWALLOWED: Get medical help.

    P330 Rinse mouth.

    Storage

    none

    Disposal

    P501 Dispose of contents/container to an appropriate treatment and disposal facility in accordance with applicable laws and regulations, and product characteristics at time of disposal.

    Other hazards which do not result in classification

    no data available

    Handling and Storage

    Precautions for safe handling

    Handling in a well ventilated place. Wear suitable protective clothing. Avoid contact with skin and eyes. Avoid formation of dust and aerosols. Use non-sparking tools. Prevent fire caused by electrostatic discharge steam.

    Conditions for safe storage, including any incompatibilities

    Store the container tightly closed in a dry, cool and well-ventilated place. Store apart from foodstuff containers or incompatible materials.

  • Seller Information
    Business Type:

    Manufactory

    Main Products:

    Agrochemicals,Daily Chemicals,Catalysts & Chemical Auxiliary Agents,Extract,Inorganic Chemicals,Organic Intermediate

    Location:

    hisense intelligence valley,no 2116,of phoenix road

    Payment Terms:

    TT against copy of documents,D/P,L/C

    Average lead Time:

    7

    Total Annual Revenue:

    Less than $1 million

    Total Employees:

    11-50

    Year of Establishment:

    2017

     SHANDONG LOOK CHEMICAL CO.LTD, a new chemical enterprise in researching, manufacturing and supplying of chemicals located in beautiful “Spring City”-Jinan.Our company mainly working on the researching new-born APIs, intermediate ( especially Carbohydrate derivatives series). Meanwhile, we made huge breakthrough in industries of food, feed additives, cosmetics ,dye and industrial chemicals. Our company enjoyed great reputation both domestic and abroad under the belief of “Integrity management,Quality controlling and Customer orientation”.  Web : www.chinalookchemical.com 

        We had been cooperated with NingXia University and Shandong University on more than ten projects for years and which had been in mass production on the market. We now have more than 80 people in our team and built research center in Jinan and Ningxia. Our manufacturing site allocated in chemical industry parks of Zhangqiu, Heze, Dezhou and Ningxia Fine Chemical Park. We strictly complying with ISO9001 and ISO 2000 standard in manufacturing process, our lab and workshop tightly in accordance with GMP standard.Our products best selling in Europe, South and North America,Asia pacific area and Africa. We sincerely welcome new and regular customers around the world visit us for business negotiation.

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