2-Amino-4'-methylacetophenone hydrochloride

Base Information

• Chemical Name: 2-Amino-4'-methylacetophenone hydrochloride
• CAS No.: 5467-70-9
• Molecular Formula: C9H11 N O . Cl H
• Molecular Weight: 185.653
• Hs Code.: 2922399090
• European Community (EC) Number: 892-357-1
• DSSTox Substance ID: DTXSID30500068
• NSC Number: 25403
• Mol file: 5467-70-9.mol

Synonyms:5467-70-9;2-amino-4'-methylacetophenone hydrochloride;4-methylphenacylamine hydrochloride;2-Amino-1-(p-tolyl)ethanone hydrochloride;2-Amino-4'-methylacetophenone HCl;MFCD00197519;2-amino-1-(4-methylphenyl)ethanone;hydrochloride;2-oxo-2-p-tolyl-ethylammonium chloride;2-Amino-1-(4-methylphenyl)-ethanone Hydrochloride;2-amino-1-(4-methylphenyl)ethan-1-one hydrochloride;2-Amino-1-(4-methylphenyl)ethanone-d3Hydrochloride;1794977-34-6;2-amino-1-p-tolylethanone hydrochloride;2-(4-methylphenyl)-2-oxoethan-1-aminium chloride;2-Amino-1-P-Tolyl-Ethanone Hydrochloride;SCHEMBL5411912;DTXSID30500068;IHWOUORJQZGRRF-UHFFFAOYSA-N;NSC25403;AM1070;NSC-25403;AKOS005132880;2-oxo-2-p-tolyl-ethyl-ammonium chloride;2-AMINO-1-(P-TOLYL)ETHANONE HCL;AC-24481;DS-12703;SY104003;2-amino-1-p-tolyl-ethanone, hydrochloride;2-oxo-2-p-tolyl-ethyl-ammonium, chloride;A7937;BB 0323438;FT-0635746;C75563;EN300-3031456;?2-AMINO-4'-METHYLACETOPHENONE HYDROCHLORIDE;Z275368898;Ethanone, 2-amino-1-(4-methylphenyl)-, hydrochloride (1:1);2-Amino-1-(4-methylphenyl)ethan-1-one--hydrogen chloride (1/1);|A-Amino-4 inverted exclamation mark -tolylacetophenone hydrochloride

Chemical Property of 2-Amino-4'-methylacetophenone hydrochloride

Chemical Property:

• Melting Point: 220ºC (dec.)
• Boiling Point: 272.6°Cat760mmHg
• Flash Point: 118.7°C
• PSA: 43.09000
• Density: 1.058g/cm³
• LogP: 2.63870
• Storage Temp.: -20°C Freezer
• Solubility.: Methanol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 185.0607417
• Heavy Atom Count: 12
• Complexity: 137

Purity/Quality:

99.5% ^*data from raw suppliers

2-Amino-1-(4-methylphenyl)-ethanoneHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)CN.Cl

Technology Process of 2-Amino-4'-methylacetophenone hydrochloride

There total 12 articles about 2-Amino-4'-methylacetophenone hydrochloride 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: 98.0%

C11H11NO3 (127118-89-2) → 2-amino-4'-methylacetophenone hydrochloride (5467-70-9)

Guidance literature:

With hydrogenchloride; ethanol; for 48h; Ambient temperature;

DOI:10.1055/s-1990-26959

Reference yield: 94.0%

methyl 2-amino-3-oxo-3-p-tolylpropionate hydrochloride (93102-92-2) → 2-amino-4'-methylacetophenone hydrochloride (5467-70-9)

Guidance literature:

With hydrogenchloride;

DOI:10.1248/cpb.32.2536

Reference yield: 85.0%

2-nitro-1-(p-tolyl)ethan-1-one (62968-73-4) → 2-amino-4'-methylacetophenone hydrochloride (5467-70-9)

Guidance literature:

With hydrogen; sulfided platinum on carbon; In hydrogenchloride; ethanol; at 50 ℃; for 11.5h; under 760 Torr;

DOI:10.1016/S0040-4039(00)85319-8

upstream raw materials:

2-nitro-1-(p-tolyl)ethan-1-one

C₁₁H₁₁NO₃

methyl 2-amino-3-oxo-3-p-tolylpropionate hydrochloride

sodium diformamide

Downstream raw materials:

5,7,7-trimethyl-2-p-tolyl-7H-thiazolo[3,2-a]pyrimidine

N-(4-Methylbenzoylmethyl)pyrrole

4-(5-p-Tolyl-oxazol-2-yl)-pyridine

N-(trans-2-Iodocyclohexyl)-N'-(p-methylphenacyl)urea

Refernces

• 1、 Jia, Tingting,Zeng, Gongruixue,Zhang, Chong,Zeng, Linghui,Zheng, Wenya,Li, Siyao,Wu, Keyi,Shao, Jiaan,Zhang, Jiankang,Zhu, Huajian. "The reaction of prop-2-ynylsulfonium salts and sulfonyl-protected β-amino ketones to epoxide-fused 2-methylenepyrrolidines and S-containing pyrroles". supporting information. p. 2657 - 2660. Retrieved 2021/03/16.
• 2、 Chang, Junbiao,Yu, Wenquan,Zhang, Shuangshuang,Zhao, Qiongli,Zhao, Yifei. "Synthesis of 2-Amino Substituted Oxazoles from α-Amino Ketones and Isothiocyanates via Sequential Addition and I2-Mediated Desulfurative Cyclization". supporting information. . Retrieved 2020/04/29.