Formamide, N-(3-pyridinylmethyl)-

Base Information

• Chemical Name: Formamide, N-(3-pyridinylmethyl)-
• CAS No.: 56625-04-8
• Molecular Formula: C7H8N2O
• Molecular Weight: 136.153
• DSSTox Substance ID: DTXSID80481414
• Nikkaji Number: J3.281.962A
• Wikidata: Q82316818
• Mol file: 56625-04-8.mol

Synonyms:Formamide, N-(3-pyridinylmethyl)-;N-(pyridin-3-ylmethyl)formamide;56625-04-8;SCHEMBL348709;N-Pyridin-3-ylmethyl-formamide;DTXSID80481414;AKOS006292588;F1984-0345

Chemical Property of Formamide, N-(3-pyridinylmethyl)-

Chemical Property:

• PSA: 45.48000
• LogP: 1.16790
• XLogP3: 0
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 136.063662883
• Heavy Atom Count: 10
• Complexity: 106

Purity/Quality:

N-Pyridin-3-ylmethyl-formamide 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CN=C1)CNC=O

Technology Process of Formamide, N-(3-pyridinylmethyl)-

There total 7 articles about Formamide, N-(3-pyridinylmethyl)- 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: 99.0%

3-Aminomethylpyridine (3731-52-0) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → N-(pyridine-2-yl)methylformamide (56625-04-8)

Guidance literature:

N,N-dimethyl-formamide; With bis(2-chlorophenyl)borinic acid; acetic acid; at 65 ℃; for 0.25h; Inert atmosphere;

3-Aminomethylpyridine; at 65 ℃; for 12h; Temperature; Inert atmosphere;

DOI:10.1002/chem.201600234

Reference yield: 98.0%

3-Aminomethylpyridine (3731-52-0) + formamide (77287-34-4,77287-35-5,60100-09-6) → N-(pyridine-2-yl)methylformamide (56625-04-8)

Guidance literature:

With benzoic acid; In para-xylene; at 80 ℃; for 1h; Inert atmosphere; Schlenk technique;

DOI:10.1002/adsc.201400068

Reference yield: 79.0%

3-Aminomethylpyridine (3731-52-0) + formic acid ethyl ester (109-94-4) → N-(pyridine-2-yl)methylformamide (56625-04-8)

Guidance literature:

at 60 ℃; for 4h;

upstream raw materials:

3-Aminomethylpyridine

formic acid ethyl ester

4-chlorobenzaldehyde

(3-Pyridylmethyl)isonitrile

Downstream raw materials:

N-Methyl-N-pyridin-3-ylmethyl-formamide

N-methyl-N-(3-pyridylmethyl)amine

3-(1-methyl-pyrrolidin-2-yl)-pyridine

(3-Pyridylmethyl)isonitrile