Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate

Base Information

• Chemical Name: Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate
• CAS No.: 1458-18-0
• Molecular Formula: C6H5 Cl2 N3 O2
• Molecular Weight: 222.031
• Hs Code.: 29339980
• European Community (EC) Number: 215-947-7
• DSSTox Substance ID: DTXSID8057645
• Nikkaji Number: J298.644B
• Wikidata: Q69757027
• ChEMBL ID: CHEMBL3184300
• Mol file: 1458-18-0.mol

Synonyms:Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate;1458-18-0;Methyl 3-amino-5,6-dichloro-2-pyrazinecarboxylate;C6H5Cl2N3O2;MFCD00010431;DTXSID8057645;3-Amino-5,6-dichloro-2-pyrazinecarboxylic Acid Methyl Ester;Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester;EINECS 215-947-7;EC 215-947-7;methyl 3-amino-5,6-dichloro-2-pyrazine-carboxylat;3-Amino-5,6-dichloro-pyrazine-2-carboxylic acid methyl ester;SCHEMBL507599;CHEMBL3184300;DTXCID9031434;C6-H5-Cl2-N3-O2;3-Amino-5,6-dichloropyrazine-2-carboxylic acid methyl ester;2-Pyrazinecarboxylic acid, 3-amino-5,6-dichloro-, methyl ester;AMY10563;Tox21_113824;AKOS015919778;CS-W019909;SS-6054;Methyl 3-amino-5,6-dichloropyrazinoate;NCGC00253704-01;AC-25140;SY101527;CAS-1458-18-0;FT-0633560;EN300-116878;F18406;methyl 3-amino-5,6-dichloropyrazinecarboxylate;2-amino-5,6-dichloro-3-(methoxycarbonyl)pyrazine;A852581;SR-01000944758;J-200106;methyl 3-amino-5,6-dichloro-2-pyrazine carboxylate;SR-01000944758-1;3-Amino-5,6-dichloropyrazinecarboxylic acid methyl ester;Methyl 3-amino-5,6-dichloro-2-pyrazinecarboxylate, 97%;3-Amino-5,6-dichloropyrazinecarboxylic acid, methyl ester

Chemical Property of Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate

Chemical Property:

• Appearance/Colour: light brown to red-brown powder
• Vapor Pressure: 2.76E-05mmHg at 25°C
• Melting Point: 227-230 °C
• Boiling Point: 357.3°Cat760mmHg
• PKA: -2.74±0.10(Predicted)
• Flash Point: 169.9°C
• PSA: 78.10000
• Density: 1.586g/cm³
• LogP: 1.73340
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• Solubility.: Chloroform (Slightly), Dichloromethane (Slightly), DMSO (Slightly), Methanol (Sl
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 220.9758818
• Heavy Atom Count: 13
• Complexity: 204

Purity/Quality:

99.9% ^*data from raw suppliers

3-Amino-5,6-dichloro-2-pyrazinecarboxylicAcidMethylEster ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,Xi
• Statements: 36/37/38-20/22-20
• Safety Statements: 36/37/39-26-22-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC(=O)C1=C(N=C(C(=N1)Cl)Cl)N
• Uses: 3-Amino-5,6-dichloro-2-pyrazinecarboxylic Acid Methyl Ester, is used for the preparation of 2-Amidino analogs of glycine-Amiloride (A578700) conjugates, acting as inhibitors of the protease urokinase plasminogen activator (uPA), a promising anticancer targets. Dyes and metabolites.

Technology Process of Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate

There total 1 articles about Methyl 3-amino-5,6-dichloropyrazine-2-carboxylate 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:

→ methyl 6-amino-2,3-dichloropyrazine-5-carboxylate (1458-18-0)

Guidance literature:

3-Amino-pyrazin-2-carbonsaeure-methylester u. Sulfurylchlorid;

Reference yield: 97.0%

phenethylamine (64-04-0) + methyl 6-amino-2,3-dichloropyrazine-5-carboxylate (1458-18-0) → methyl 3-amino-6-chloro-5-(phenethylamino)pyrazine-2-carboxylate (2032-81-7)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; Inert atmosphere;

DOI:10.1039/c6md00729e

Reference yield: 91.0%

methyl 6-amino-2,3-dichloropyrazine-5-carboxylate (1458-18-0) + benzylamine (100-46-9) → methyl 3-amino-5-(benzylamino)-6-chloropyrazine-2-carboxylate (1154-82-1)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; Inert atmosphere;

DOI:10.1039/c6md00729e

Downstream raw materials:

3-Amino-5-(1-benzyl-piperidin-4-ylamino)-6-chloro-pyrazine-2-carboxylic acid methyl ester

methyl 3-bromo-5-(4-methylpiperazinyl)-6-chloro-2-pyrazinecarboxylate

3-Amino-5-ethoxycarbonylmethyl-6-phenyl-pyrazine-2-carboxylic acid methyl ester

methyl 3-amino-5-<(ethoxycarbonyl)aminomethyl>-6-chloropyrazinoate