4-Amino-N,N-dimethylbenzamide

Base Information

• Chemical Name: 4-Amino-N,N-dimethylbenzamide
• CAS No.: 6331-71-1
• Molecular Formula: C9H12N2O
• Molecular Weight: 164.207
• Hs Code.: 2924299090
• European Community (EC) Number: 676-807-2
• NSC Number: 233921,37002
• DSSTox Substance ID: DTXSID50284378
• Nikkaji Number: J2.802.744C
• Wikidata: Q72436218
• ChEMBL ID: CHEMBL3278328
• Mol file: 6331-71-1.mol

Synonyms:4-Amino-N,N-dimethylbenzamide;6331-71-1;N,N-Dimethyl 4-aminobenzamide;Benzamide, 4-amino-N,N-dimethyl-;4-Amino-N,N-DiMethyl-Benzamide;MFCD00523648;N,N-dimethyl-p-aminobenzamide;NSC37002;Oprea1_566051;p-amino-N,N-dimethylbenzamide;SCHEMBL354426;CHEMBL3278328;DTXSID50284378;4-(N,N-dimethylcarbamoyl)aniline;4-Amino-N,N-dimethylbenzamide #;HMS1755F03;4-NH2-C6H4CON(CH3)2;NSC-37002;NSC233921;STK865611;AKOS000111616;NSC-233921;SB75837;SS-4049;SY024835;4-Amino-N,N-dimethylbenzamide, AldrichCPR;BB 0246510;CS-0071544;FT-0600530;EN300-09518;C75974;A834327;J-514444;Z56979314;F3304-0005

Chemical Property of 4-Amino-N,N-dimethylbenzamide

Chemical Property:

• Vapor Pressure: 5.19E-05mmHg at 25°C
• Melting Point: 151-154 °C
• Refractive Index: 1.579
• Boiling Point: 348 °C at 760 mmHg
• PKA: 2.66±0.10(Predicted)
• Flash Point: 164.3 °C
• PSA: 46.33000
• Density: 1.116 g/cm³
• LogP: 1.55180
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Water Solubility.: Very soluble in water.
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 164.094963011
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

99.5% ^*data from raw suppliers

N,N-Dimethyl4-Aminobenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C(=O)C1=CC=C(C=C1)N
• Uses: 4-Amino-N,N-dimethylbenzamide is an important raw material and intermediate used in pharmaceuticals, agro based and dye stuff fields.

Technology Process of 4-Amino-N,N-dimethylbenzamide

There total 14 articles about 4-Amino-N,N-dimethylbenzamide 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%

N,N-dimethyl-4-nitrobenzamide (7291-01-2) → 4-amino-N,N-dimethylbenzamide (6331-71-1)

Guidance literature:

With 1,1,3,3-Tetramethyldisiloxane; In ethanol; at 20 ℃; for 0.75h; chemoselective reaction; Inert atmosphere; Sonication;

DOI:10.1039/c2ob27025k

Reference yield: 73.0%

4-amino-benzoic acid (150-13-0,159246-81-8,8014-65-1) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 4-amino-N,N-dimethylbenzamide (6331-71-1)

Guidance literature:

With tert.-butylhydroperoxide; copper(II) oxide; In water; at 80 ℃; for 15h;

DOI:10.1039/c3ra41000e

Reference yield: 65.0%

N,N-dimethylammonium chloride (506-59-2) + 4-amino-benzoic acid (150-13-0,159246-81-8,8014-65-1) → 4-amino-N,N-dimethylbenzamide (6331-71-1)

Guidance literature:

N,N-dimethylammonium chloride; 4-amino-benzoic acid; With triethylamine; In dichloromethane; at 10 ℃; for 0.166667h;

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 20 ℃;

upstream raw materials:

N,N-dimethyl-4-nitrobenzamide

dimethyl amine

4-aminobenzoyl chloride

fenuron

Downstream raw materials:

p-[(7-trifluoromethyl-4-quinolyl)amino]-N,N-dimethylbenzamide

4-{4-[3-(cyclobutanecarbonyl-amino)-propylamino]-5-cyclopropyl-pyrimidin-2-ylamino}-N,N-dimethyl-benzamide

4-[3-(4-bromo-phenyl)-ureido]-N,N-dimethyl-benzamide

2,2,2-trichioroethyl (4-(dimethylcarbamoyl)phenyl)carbamate

Refernces

• 1、 Gholinejad, Mohammad,Shojafar, Mohammad,Sansano, José M.. "Enhanced catalytic activity of natural hematite-supported ppm levels of Pd in nitroarenes reduction". . p. 2033 - 2043. Retrieved 2020/04/07.
• 2、 -. "CDK INHIBITORS". Page/Page column 87-89. . Retrieved 2020/11/23.