2-Anilinoacetamide

Base Information

• Chemical Name: 2-Anilinoacetamide
• CAS No.: 21969-70-0
• Molecular Formula: C8H10 N2 O
• Molecular Weight: 150.18
• Hs Code.: 2924199090
• European Community (EC) Number: 887-315-4
• DSSTox Substance ID: DTXSID30572083
• Nikkaji Number: J410.714D
• Wikidata: Q82460340
• Mol file: 21969-70-0.mol

Synonyms:2-amino-2-phenylethanamide;PGA glycine cpd;phenylglycinamide;phenylglycine amide

Chemical Property of 2-Anilinoacetamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.615
• Boiling Point: 385.762°C at 760 mmHg
• Flash Point: 187.102°C
• PSA: 56.11000
• Density: 1.19g/cm³
• LogP: 1.80650
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 150.079312947
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

99% ^*data from raw suppliers

2-Anilinoacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NCC(=O)N
• Uses: 2-Anilinoacetamide is used as initial substrate for the enzymic synthesis of Cephalexin (C256800) with liquid penicillin G acylase.

Technology Process of 2-Anilinoacetamide

There total 16 articles about 2-Anilinoacetamide 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: 100.0%

→ 2-anilinoacetamide (21969-70-0)

Guidance literature:

Reference yield: 99.0%

N-phenylglycine ethyl ester (2216-92-4) → 2-anilinoacetamide (21969-70-0)

Guidance literature:

With ammonium hydroxide; sodium hydroxide; In methanol; at 25 ℃; for 24h;

DOI:10.1002/ejoc.201600549

Reference yield: 75.0%

2,6-diphenyl-1-oxa-2,5-diaza-4-oxo-cyclohexane (178869-03-9) → 2-anilinoacetamide (21969-70-0)

Guidance literature:

With hexacarbonyl molybdenum; water; In acetonitrile; for 0.333333h; Heating;

DOI:10.1016/0040-4020(96)00268-2

upstream raw materials:

trans-Crotonaldehyde

N-phenylglycinonitrile

N-anilinomethyl formanilide

potassium cyanide

Downstream raw materials:

N-(N-phenyl-glycyl)-glycine diethylamide

4-phenylpiperazine-2,6-dione

N-Phenylglycine

2-amino-N-phenylacetamide hydrochloride

Refernces

• 1、 Castillo, Juan-Carlos,Orrego-Hernández, Jessica,Portilla, Jaime. "Cs2CO3-Promoted Direct N-Alkylation: Highly Chemoselective Synthesis of N-Alkylated Benzylamines and Anilines". . p. 3824 - 3835. Retrieved 2016/08/20.
• 2、 -. "Process for producing optically active alpha-amino acid and optically active alpha-amino acid amine". . . Retrieved 2008/06/13.