1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid

Base Information

• Chemical Name: 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid
• CAS No.: 67058-74-6
• Molecular Formula: C8H6N2O2
• Molecular Weight: 162.1454
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10496995
• Wikidata: Q72505626

Synonyms:1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid;67058-74-6;6-AZAINDOLE-3-CARBOXYLIC ACID;MFCD11845479;1H-Pyrrolo[2,3-c]pyridine-3-carboxylicacid;6-Azaindole-3-carboxalicacid;SCHEMBL2052704;AMY7417;DTXSID10496995;UZICFJZCPFIGIJ-UHFFFAOYSA-N;AKOS015999197;GS-6146;PB19178;SY098589;CS-0044734;FT-0654726;EN300-256134;A835622

Chemical Property of 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid

Chemical Property:

• Melting Point: 194-195℃
• Boiling Point: 471.131 °C at 760 mmHg
• Flash Point: 238.731 °C
• PSA: 65.98000
• Density: 1.507 g/cm³
• LogP: 1.26110
• Storage Temp.: 2-8°C
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 162.042927438
• Heavy Atom Count: 12
• Complexity: 196

Purity/Quality:

99%, ^*data from raw suppliers

1H-Pyrrolo[2,3-c]pyridine-3-carboxylicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=CC2=C1C(=CN2)C(=O)O

Technology Process of 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid

There total 5 articles about 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid 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: 85.0%

2,2,2-trichloro-1-(1H-pyrrolo[2,3-c]pyridin-3-yl)-ethanone (1313266-67-9) → 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid (67058-74-6)

Guidance literature:

2,2,2-trichloro-1-(1H-pyrrolo[2,3-c]pyridin-3-yl)-ethanone; With water; sodium hydroxide; at 110 ℃;

With hydrogenchloride; In water; pH=2;

Reference yield: 73.88%

methyl 1H-pyrrolo[2,3-c]pyridine-3-carboxylate (108128-12-7) → 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid (67058-74-6)

Guidance literature:

With water; sodium hydroxide; In tetrahydrofuran; methanol; at 30 ℃; for 2h;

Reference yield:

6-azaindole (271-29-4) → 1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid (67058-74-6)

Guidance literature:

Multi-step reaction with 2 steps

1.1: aluminum (III) chloride / dichloromethane / 2 h / 48 °C

2.1: sodium hydroxide; water / 110 °C

2.2: pH 2

With aluminum (III) chloride; water; sodium hydroxide; In dichloromethane;

upstream raw materials:

6-azaindole

2,2,2-trichloro-1-(1H-pyrrolo[2,3-c]pyridin-3-yl)-ethanone

methyl 1H-pyrrolo[2,3-c]pyridine-3-carboxylate

Downstream raw materials:

6-azaindole

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