methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate

Base Information

• Chemical Name: methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate
• CAS No.: 100418-45-9
• Molecular Formula: C₁₁H₁₁N₃O₄S
• Molecular Weight: 281.292
• Mol file: 100418-45-9.mol

Synonyms:methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate

Chemical Property of methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate

Chemical Property:

Purity/Quality:

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MSDS Files:

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Technology Process of methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate

There total 2 articles about methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 79.0%

4-(2-Methanesulfonyloxy-ethylamino)-3-nitro-benzoic acid methyl ester (100418-38-0) + potassium thioacyanate (333-20-0) → methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate (100418-45-9)

Guidance literature:

Heating;

DOI:10.1016/S0040-4020(01)89768-4

Reference yield:

4-(2-hydroxyethylamino)-3-nitro-benzoic acid methyl ester (59320-15-9) → methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate (100418-45-9)

Guidance literature:

Multi-step reaction with 2 steps

1: 65 percent / pyridine / Ambient temperature

2: 79 percent / Heating

With pyridine;

DOI:10.1016/S0040-4020(01)89768-4

Reference yield:

methyl 3-nitro-4-N-(2-thiocyanatoethyl)-aminobenzoate (100418-45-9) → 2-imino-3-(4'-methoxycarbonyl-2'-nitrophenyl)-thiazolidine hydrochloride

Guidance literature:

With hydrogenchloride; In methanol;

upstream raw materials:

4-(2-Methanesulfonyloxy-ethylamino)-3-nitro-benzoic acid methyl ester

potassium thioacyanate

4-(2-hydroxyethylamino)-3-nitro-benzoic acid methyl ester

Downstream raw materials:

2-imino-3-(2'-amino-4'-methoxycarbonylphenyl)-thiazolidine dihydrochloride

Refernces