2-Chloro-1-(4-hydroxy-2-methylphenyl)ethanone

Base Information

• Chemical Name: 2-Chloro-1-(4-hydroxy-2-methylphenyl)ethanone
• CAS No.: 37904-71-5
• Molecular Formula: C₉H₉ClO₂
• Molecular Weight: 184.622
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID50404852
• Wikidata: Q82209190
• Mol file: 37904-71-5.mol

Synonyms:2-chloro-1-(4-hydroxy-2-methylphenyl)ethanone;37904-71-5;2-chloro-1-(4-hydroxy-2-methylphenyl)ethan-1-one;DTXSID50404852;AKOS022518047;Ethanone, 2-chloro-1-(4-hydroxy-2-methylphenyl)-

Chemical Property of 2-Chloro-1-(4-hydroxy-2-methylphenyl)ethanone

Chemical Property:

• Melting Point: 102-102.5 °C
• Boiling Point: 348.9±27.0 °C(Predicted)
• PKA: 7.86±0.20(Predicted)
• PSA: 37.30000
• Density: 1 +-.0.06 g/cm3(Predicted)
• LogP: 2.12210
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 184.0291072
• Heavy Atom Count: 12
• Complexity: 170

Purity/Quality:

95% ^*data from raw suppliers

2-CHLORO-1-(4-HYDROXY-2-METHYLPHENYL)-ETHANONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)O)C(=O)CCl

Technology Process of 2-Chloro-1-(4-hydroxy-2-methylphenyl)ethanone

There total 1 articles about 2-Chloro-1-(4-hydroxy-2-methylphenyl)ethanone 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:

chloro-acetic acid m-tolyl ester (501357-08-0) → 2-chloro-1-(4-hydroxy-2-methyl-phenyl)-ethanone (37904-71-5)

Guidance literature:

With aluminium trichloride; at 140 ℃;

Reference yield: 88.0%

2-chloro-1-(4-hydroxy-2-methyl-phenyl)-ethanone (37904-71-5) + N-(4-methyl-2-pyridinyl)-N'-phenyl thiourea (53385-81-2) → 3-Methyl-4-{2-[(Z)-4-methyl-pyridin-2-ylimino]-3-phenyl-2,3-dihydro-thiazol-4-yl}-phenol

Guidance literature:

In ethanol; for 5h; Heating;

DOI:10.1016/S0014-827X(02)01250-8

Reference yield: 65.0%

2-chloro-1-(4-hydroxy-2-methyl-phenyl)-ethanone (37904-71-5) + 3-indan-5-yl-5-phenyl-4,5-dihydro-pyrazole-1-carbothioic acid amide → 1-[4-(2'-methyl-4'-hydroxyphenyl)thiazol-2-yl]-3-(indan-5''-yl)-5-phenyl-2-pyrazoline

Guidance literature:

In ethanol; for 1h; Heating;

DOI:10.1016/S0223-5234(00)00152-5

upstream raw materials:

chloro-acetic acid m-tolyl ester

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