(4-Aminophenyl)(morpholino)methanone

Base Information

• Chemical Name: (4-Aminophenyl)(morpholino)methanone
• CAS No.: 51207-86-4
• Molecular Formula: C11H14N2O2
• Molecular Weight: 206.244
• Hs Code.: 2934999090
• European Community (EC) Number: 672-072-7
• DSSTox Substance ID: DTXSID30342021
• Nikkaji Number: J1.310.823D
• Wikidata: Q82112547
• Mol file: 51207-86-4.mol

Synonyms:(4-aminophenyl)(morpholino)methanone;51207-86-4;(4-aminophenyl)-morpholin-4-ylmethanone;(4-Amino-phenyl)-morpholin-4-yl-methanone;4-(morpholine-4-carbonyl)aniline;Morpholine, 4-(4-aminobenzoyl)-;4-(morpholin-4-ylcarbonyl)aniline;MFCD00158788;(4-Aminophenyl)morpholin-4-ylmethanone;(4-aminophenyl)morpholin-4-yl-methanone;(4-aminophenyl)(morpholin-4-yl)methanone;p-Aminobenzoylmorpholine;4-aminobenzoylmorpholine;TimTec1_001264;Oprea1_230628;Oprea1_597630;4-Aminophenylmorpholino ketone;SCHEMBL103440;DTXSID30342021;HMS1537J10;4-(4-Morpholinylcarbonyl)aniline #;STK247621;(4-amino-phenyl)(morpholino)methanone;(4-aminophenyl) (morpholino)methanone;(4-aminophenyl)(morpholino)-methanone;4-(morpholin-4-ylcarbonyl)phenylamine;AKOS000111604;CS-W021099;PB42950;(4-aminophenyl)(4-morpholinyl)methanone;NCGC00174614-01;(4-aminophenyl)-(4-morpholinyl)methanone;(4-aminophenyl)-morpholin-4-yl-methanone;AM803976;SY024885;Methanone, (4-aminophenyl)(4-morpholyl)-;BB 0237275;FT-0661592;(4-AMINO PHENYL)(MORPHOLINO)METHANONE;EN300-36606;7X-0704;A828484;AN-465/25028019;SR-01000394743;J-501351;SR-01000394743-1;BRD-K72410872-001-01-2;Z239124292

Chemical Property of (4-Aminophenyl)(morpholino)methanone

Chemical Property:

• Vapor Pressure: 1.71E-07mmHg at 25°C
• Melting Point: 132-135 °C
• Refractive Index: 1.6
• Boiling Point: 426.9°C at 760 mmHg
• PKA: 3.43±0.10(Predicted)
• Flash Point: 212°C
• PSA: 55.56000
• Density: 1.228g/cm³
• LogP: 1.26030
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 206.105527694
• Heavy Atom Count: 15
• Complexity: 219

Purity/Quality:

98%min ^*data from raw suppliers

p-Aminobenzoylmorpholine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1C(=O)C2=CC=C(C=C2)N
• Uses: (4-Amino-Phenyl)-Morpholin-4-yl-Methanone is an morpholine derivative used in the preparation of tyrosine kinase inhibitors and other biologically active agents.

Technology Process of (4-Aminophenyl)(morpholino)methanone

There total 14 articles about (4-Aminophenyl)(morpholino)methanone 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%

1-morpholin-4-yl-1-(4-nitro-phenyl)-methanone (5397-76-2) → (4-amino-phenyl)-morpholin-4-yl-methanone (51207-86-4)

Guidance literature:

With sodium tetrahydroborate; TPGS-750-M; In tetrahydrofuran; water; at 20 ℃; for 0.5h;

DOI:10.1039/c7gc02991h

Reference yield: 82.0%

morpholine (110-91-8,99108-56-2) + 4-aminobenzaldehyde (556-18-3,28107-09-7) → (4-amino-phenyl)-morpholin-4-yl-methanone (51207-86-4)

Guidance literature:

With sulfuric acid; dihydrogen peroxide; sodium bromide; In 1,4-dioxane; water; at 80 ℃; for 0.416667h; Flow reactor; Green chemistry;

DOI:10.1039/c6ra16240a

Reference yield: 75.5%

→ (4-amino-phenyl)-morpholin-4-yl-methanone (51207-86-4)

Guidance literature:

With iron; ammonium chloride; In methanol; water; at 70 ℃; for 5h;

upstream raw materials:

1-morpholin-4-yl-1-(4-nitro-phenyl)-methanone

4-nitro-benzoyl chloride

tert-butyl (4-(morpholine-4-carbonyl)phenyl)carbamate

morpholine

Downstream raw materials:

cyclobutanecarboxylic acid (3-{2-[4-(morpholine-4-carbonyl)-phenylamino]-pyrrolo[2,3-d]pyrimidin-7-yl}-propyl)-amide

2,6-difluoro-N-(4-(morpholine-4-carbonyl)phenylcarbamoyl)benzamide

6-tert-butyl-8-fluoro-2-(2-hydroxymethyl-3-{2-[5-(morpholine-4-carbonyl)-pyridin-2-ylamino]-pyridin-4-yl}-phenyl)-2H-phthalazin-1-one

acetic acid 2-(6-tert-butyl-8-fluoro-1-oxo-1H-phthalazin-2-yl)-6-{6-[5-(morpholine-4-carbonyl)-pyridin-2-ylamino]-pyridazin-4-yl}-benzyl ester

Refernces

• 1、 Luzzio, Frederick A.,Monsen, Paige J.. "Applicability of aluminum amalgam to the reduction of arylnitro groups". supporting information. . Retrieved 2020/11/02.
• 2、 -. "S-triazine compounds as well as preparation method and application thereof". Paragraph 0091; 0094. . Retrieved 2020/05/05.