Description

Methyl 2-amino-5-bromo-3-methylbenzoate (CAS No. 206548-14-3) is a high-purity organic compound with the molecular formula C₉H₁₀BrNO₂. This aromatic ester features a bromo-substituted benzene ring with an amino and methyl ester functional group, making it a versatile intermediate for pharmaceutical and agrochemical synthesis. Its molecular weight is 244.09 g/mol, and it is characterized by excellent stability under standard laboratory conditions. Ideal for researchers in medicinal chemistry, this compound is supplied with comprehensive analytical data including HPLC, NMR, and MS to ensure quality and consistency. Store in a cool, dry place away from light to maintain integrity.

Properties

• CAS Number: 206548-14-3
• Complexity: 198
• IUPAC Name: methyl 2-amino-5-bromo-3-methyl-benzoate
• InChI: InChI=1S/C9H10BrNO2/c1-5-3-6(10)4-7(8(5)11)9(12)13-2/h3-4H,11H2,1-2H3
• InChI Key: NVJKMGDNYCDLGR-UHFFFAOYSA-N
• Exact Mass: 242.98949
• Molecular Formula: C9H10BrNO2
• Molecular Weight: 244.08
• SMILES: CC1=CC(=CC(=C1N)C(=O)OC)Br
• Topological: 52.3
• Monoisotopic Mass: 242.98949
• Synonyms: methyl 2-amino-5-bromo-3-methylbenzoate, 206548-14-3, DTXSID90376943, DTXCID50327971, Methyl 2-amino-5-bromo-3-methylbenzenecarboxylate, Benzoic acid, 2-amino-5-bromo-3-methyl-, methyl ester, 2-amino-5-bromo-3-methyl-benzoic acid methyl ester, MFCD06797379, 2-amino-3-methyl-5-bromobenzoic acid methyl ester, SCHEMBL759268, NVJKMGDNYCDLGR-UHFFFAOYSA-N, GIA54814, SBB099790, AKOS002677402, SB35218, methyl2-amino-5-bromo-3-methylbenzoate, AC-29545, DA-33038, SY035916, methyl 2-amino-5-bromo-3-methyl-benzoate, CS-0035707, EN300-2008384, 2-amino-3-methyl 5-bromobenzoic acid methyl ester, 11Y-0801

Application

Methyl 2-amino-5-bromo-3-methylbenzoate is widely used as a key intermediate in the synthesis of active pharmaceutical ingredients (APIs) and specialty chemicals. Its reactive amino and bromo groups facilitate cross-coupling reactions, such as Suzuki or Buchwald-Hartwig couplings, for constructing complex heterocycles. Researchers also employ it in the development of agrochemicals and dyes due to its robust aromatic framework. This compound is particularly valuable in early-stage drug discovery for modifying lead compounds.

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%)

If you are interested or have any questions, please contact us at support@atomfair.com

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