(4-Morpholin-4-yl-phenyl)methanol

Base Information

• Chemical Name: (4-Morpholin-4-yl-phenyl)methanol
• CAS No.: 280556-71-0
• Molecular Formula: C11H15NO2
• Molecular Weight: 193.246
• Hs Code.: 2934999090
• European Community (EC) Number: 814-005-8
• DSSTox Substance ID: DTXSID80380094
• Wikidata: Q82170150
• Mol file: 280556-71-0.mol

Synonyms:(4-Morpholin-4-yl-phenyl)methanol;280556-71-0;4-Morpholinobenzyl Alcohol;(4-morpholinophenyl)methanol;(4-morpholin-4-ylphenyl)methanol;[4-(Morpholin-4-Yl)Phenyl]Methanol;(4-morpholin-4-yl-phenyl)-methanol;MFCD01057413;4-(Morpholin-4-yl)benzyl alcohol;Oprea1_840775;SCHEMBL1716021;4-(4-Morpholinyl)benzenemethanol;4-(4-Morpholinyl)benzyl alcohol;DTXSID80380094;KUAHZNZWSIDSTH-UHFFFAOYSA-N;AKOS005264668;AC-2871;CS-W002730;FS-2718;SDCCGMLS-0065994.P001;SY003205;(4-morpholin-4-yl-phenyl)methanol, AldrichCPR;EN300-179661;A876796;J-501450;Z276509292;(1R,2S)-1-AMINO-2-(HYDROXYMETHYL)-CYCLOPROPANECARBOXYLICACID

Chemical Property of (4-Morpholin-4-yl-phenyl)methanol

Chemical Property:

• Vapor Pressure: 2.12E-06mmHg at 25°C
• Melting Point: 96 °C
• Refractive Index: 1.568
• Boiling Point: 378.4 °C at 760 mmHg
• PKA: 14.40±0.10(Predicted)
• Flash Point: 182.7 °C
• PSA: 32.70000
• Density: 1.16 g/cm³
• LogP: 1.08050
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 193.110278721
• Heavy Atom Count: 14
• Complexity: 161

Purity/Quality:

98%min ^*data from raw suppliers

(4-Morpholin-4-yl-phenyl)methanol ^*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: C1COCCN1C2=CC=C(C=C2)CO

Technology Process of (4-Morpholin-4-yl-phenyl)methanol

There total 3 articles about (4-Morpholin-4-yl-phenyl)methanol 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: 91.0%

4-morpholin-4-yl-benzoic acid methyl ester (23676-05-3) → (4-morpholinophenyl)methanol (280556-71-0)

Guidance literature:

With hydrogen; C₂₈H₂₅BrMnN₂O₂P; lithium tert-butoxide; In propan-1-ol; at 100 ℃; for 12h; under 38002.6 Torr; Autoclave;

DOI:10.1002/adsc.202101376

Reference yield: 74.0%

morpholine (110-91-8,99108-56-2) + 4-bromobenzenemethanol (873-75-6) → (4-morpholinophenyl)methanol (280556-71-0)

Guidance literature:

With copper(I) oxide; N-(2-methylnaphthalen-1-yl)-N'-benzyl oxalamide; potassium hydroxide; In ethanol; at 80 ℃; for 24h; Schlenk technique; Inert atmosphere;

DOI:10.1021/acs.orglett.7b00901

Reference yield:

chloroformic acid ethyl ester (541-41-3) + 4-morpholin-4-yl-benzoic acid (7470-38-4) → (4-morpholinophenyl)methanol (280556-71-0)

Guidance literature:

With 4-methyl-morpholine; sodium borohydrid; acetic acid; In tetrahydrofuran; methanol; water;

upstream raw materials:

chloroformic acid ethyl ester

4-morpholin-4-yl-benzoic acid

morpholine

4-bromobenzenemethanol

Downstream raw materials:

3-amino-5-(3,5-dimethylisoxazol-4-yl)-1-(4-morpholinobenzyl)pyridin-2(1H)-one

C₂₃H₂₆N₄O₄

4-[4-(chloromethyl)phenyl]morpholine hydrochloride

4-chloro-N-(4-morpholinobenzyl)aniline

Refernces

• 1、 Gao, Jie,Bhunia, Subhajit,Wang, Kailiang,Gan, Lu,Xia, Shanghua,Ma, Dawei. "Discovery of N-(Naphthalen-1-yl)-N′-alkyl Oxalamide Ligands Enables Cu-Catalyzed Aryl Amination with High Turnovers". supporting information. p. 2809 - 2812. Retrieved 2017/06/07.