5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride

Base Information

• Chemical Name: 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride
• CAS No.: 1093636-79-3
• Molecular Formula: C9H8ClN3O2
• Molecular Weight: 225.634
• Hs Code.: 2933990090
• European Community (EC) Number: 846-291-5
• DSSTox Substance ID: DTXSID70589276
• Mol file: 1093636-79-3.mol

Synonyms:1093636-79-3;5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride;5-(pyridin-3-yl)-1H-pyrazole-3-carboxylic acid hydrochloride;3-(3-pyridinyl)-1H-pyrazole-5-carboxylic acid hydrochloride;3-pyridin-3-yl-1H-pyrazole-5-carboxylic acid;hydrochloride;5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acidhydrochloride;SCHEMBL71016;DTXSID70589276;VWIQXXBPFUAVED-UHFFFAOYSA-N;MFCD08098918;AKOS015849776;AKOS024301789;MCULE-3157333472;BS-37220;CS-0206770;EN300-191438;F73716;3-(3-Pyridinyl)-1H-pyrazole-5-carboxylic Acid HCl;5-(pyridin-3-yl)-1H-pyrazole-3-carboxylicacidhydrochloride;3-(Pyridin-3-yl)-1H-pyrazole-5-carboxylic acid hydrochloride;3-(Pyridin-3-yl)-1H-pyrazole-5-carboxylic acid--hydrogen chloride (1/1)

Chemical Property of 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride

Chemical Property:

• PSA: 78.87000
• LogP: 1.97190
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 225.0305042
• Heavy Atom Count: 15
• Complexity: 222

Purity/Quality:

97% ^*data from raw suppliers

5-(Pyridin-3-yl)-1H-pyrazole-3-carboxylicAcidHydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CN=C1)C2=NNC(=C2)C(=O)O.Cl

Technology Process of 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride

There total 1 articles about 5-Pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride 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:

→ 5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride (1093636-79-3)

Guidance literature:

Reference yield: 66.0%

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride (1093636-79-3) + 2-amino-1-[4-(3-trifluoromethyl-phenoxy)-piperidin-1-yl]-ethanone hydrochloride (1188375-16-7) → 5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid {2-oxo-2-[4-(3-trifluoromethyl-phenoxy)-piperidin-1-yl]-ethyl}-amide (1188373-10-5)

Guidance literature:

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride; With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.0833333h;

2-amino-1-[4-(3-trifluoromethyl-phenoxy)-piperidin-1-yl]-ethanone hydrochloride; In N,N-dimethyl-formamide; at 20 ℃;

Reference yield: 51.5%

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride (1093636-79-3) + 2-amino-1-[4-(2-chloro-phenoxy)-piperidin-1-yl]-ethanone hydrochloride (1188375-15-6) → 5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid {2-[4-(2-chloro-phenoxy)-piperidin-1-yl]-2-oxo-ethyl}-amide (1188373-11-6)

Guidance literature:

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid hydrochloride; With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.0333333h;

2-amino-1-[4-(2-chloro-phenoxy)-piperidin-1-yl]-ethanone hydrochloride; In N,N-dimethyl-formamide; at 20 ℃;

Downstream raw materials:

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid {2-oxo-2-[4-(3-trifluoromethyl-phenoxy)-piperidin-1-yl]-ethyl}-amide

5-pyridin-3-yl-1H-pyrazole-3-carboxylic acid {2-[4-(2-chloro-phenoxy)-piperidin-1-yl]-2-oxo-ethyl}-amide

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