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Atomfair Methyl 2-amino-5-nitrobenzoate C8H8N2O4 CAS 3816-62-4

Methyl 2-amino-5-nitrobenzoate (CAS No. 3816-62-4) is a high-purity nitro-substituted benzoate ester with the molecular formula C8H8N2O4. This compound features both an amino (-NH2) and a nitro (-NO2) functional group on a benzoate ester scaffold, making it a versatile intermediate for organic synthesis and pharmaceutical research. Ideal for researchers and scientists, our product is rigorously tested for purity and consistency, ensuring reliable performance in synthetic applications. Available in various quantities, Methyl 2-amino-5-nitrobenzoate is supplied with comprehensive analytical data including1H NMR,13C NMR, and HPLC chromatograms to verify quality. Store in a cool, dry place away from light to maintain stability.

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Description

Methyl 2-amino-5-nitrobenzoate (CAS No. 3816-62-4) is a high-purity nitro-substituted benzoate ester with the molecular formula C8H8N2O4. This compound features both an amino (-NH2) and a nitro (-NO2) functional group on a benzoate ester scaffold, making it a versatile intermediate for organic synthesis and pharmaceutical research. Ideal for researchers and scientists, our product is rigorously tested for purity and consistency, ensuring reliable performance in synthetic applications. Available in various quantities, Methyl 2-amino-5-nitrobenzoate is supplied with comprehensive analytical data including 1H NMR, 13C NMR, and HPLC chromatograms to verify quality. Store in a cool, dry place away from light to maintain stability.

Properties

  • CAS Number: 3816-62-4
  • Complexity: 238
  • IUPAC Name: methyl 2-amino-5-nitro-benzoate
  • InChI: InChI=1S/C8H8N2O4/c1-14-8(11)6-4-5(10(12)13)2-3-7(6)9/h2-4H,9H2,1H3
  • InChI Key: VOQBLPBLKSXCDB-UHFFFAOYSA-N
  • Exact Mass: 196.04840674
  • Molecular Formula: C8H8N2O4
  • Molecular Weight: 196.16
  • SMILES: COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N
  • Topological: 98.1
  • Monoisotopic Mass: 196.04840674
  • Synonyms: methyl 2-amino-5-nitrobenzoate, 3816-62-4, Benzoic acid, 2-amino-5-nitro-, methyl ester, DTXSID50380485, DTXCID30331511, 818-527-7, voqblpblksxcdb-uhfffaoysa-n, MFCD00278157, 2-Amino-5-nitrobenzoic acid methyl ester, SCHEMBL890895, methyl-2-amino-5-nitrobenzoate, methyl 2-amino-5-nitro-benzoate, ALBB-025574, SBB003588, AKOS003263240, CS-W005636, AC-28617, DS-13912, ST056074, SY102539, DB-069641, EN300-42629, Z54903836

Application

Methyl 2-amino-5-nitrobenzoate is widely used as a key intermediate in the synthesis of dyes, pharmaceuticals, and agrochemicals. Its nitro and amino functional groups make it suitable for further derivatization, such as reduction to diamino derivatives or cyclization reactions. Researchers utilize this compound in the development of heterocyclic compounds and as a building block for complex organic molecules. It is also employed in academic and industrial laboratories for studying nitro-aromatic chemistry and reaction mechanisms.

Safety and Hazards

GHS Hazard Statements

  • H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
  • H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
  • H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

  • P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

  • Acute Tox. 4 (100%)
  • Skin Irrit. 2 (100%)
  • Eye Irrit. 2A (100%)
  • STOT SE 3 (100%)

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Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

Patent & Regulatory Compliance

Certain molecules may be protected by active patents or regulatory restrictions.

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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