Anisamidoxime

Base Information

• Chemical Name: Anisamidoxime
• CAS No.: 5373-87-5
• Molecular Formula: C8H10N2O2
• Molecular Weight: 166.18
• Hs Code.: 2925290090
• European Community (EC) Number: 676-507-1
• Mol file: 5373-87-5.mol

Synonyms:Anisamidoxime;p-ANISAMIDOXIME;p-Methoxybenzamide oxime;5373-87-5;p-Methoxybenzamidoxime;4-Methoxybenzamidoxime;Benzenecarboximidamide, N-hydroxy-4-methoxy-;N-Hydroxy-4-methoxybenzenecarboximidamide;N'-Hydroxy-4-methoxybenzenecarboximidamide;N-Hydroxy-4-methoxy-benzamidine;AKOS003946115;LS-20062

Chemical Property of Anisamidoxime

Chemical Property:

• Melting Point: 122-128 °C
• Boiling Point: 344.8 °C at 760 mmHg
• Flash Point: 162.3 °C
• PSA: 67.84000
• Density: 1.21 g/cm³
• LogP: 1.49000
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 166.074227566
• Heavy Atom Count: 12
• Complexity: 162

Purity/Quality:

98%Min ^*data from raw suppliers

N''-Hydroxy-4-methoxybenzenecarboximidamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T
• Statements: 36/37/38-25
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C(=NO)N
• Isomeric SMILES: COC1=CC=C(C=C1)/C(=N\O)/N

Technology Process of Anisamidoxime

There total 28 articles about Anisamidoxime 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: 100.0%

4-methoxybenzonitrile (874-90-8) → 4-methoxybenzamidoxime (5373-87-5)

Guidance literature:

With hydroxylamine; In ethanol; water; Reflux;

DOI:10.1002/chem.201603222

Reference yield: 100.0%

4-methoxybenzonitrile (874-90-8) → N-hydroxy-4-methoxybenzene-1-carboximidamide (5373-87-5)

Guidance literature:

With hydroxylamine hydrochloride; N-ethyl-N,N-diisopropylamine; In ethanol; for 10h; Reflux;

Reference yield: 99.0%

4-methoxybenzonitrile (874-90-8) → (Z)-N'-hydroxy-4-methoxybenzenecarboximidamide (5373-87-5)

Guidance literature:

With hydroxylamine; In ethanol; for 3h; Heating / reflux;

upstream raw materials:

4-methoxybenzonitrile

N-hydroxy-4-methoxy-benzenecarboximidoyl chloride

methanol

ethanol

Downstream raw materials:

3-(4-methoxyphenyl)-1,2,4-oxadiazole

N-(3-chloro-propionyloxy)-4-methoxy-benzamidine

methyl 2-(4-methoxyphenyl)imidazole-5-carboxylate

3-(4-methoxyphenyl)-5-vinyl-1,2,4-oxadiazole

Refernces

• 1、 Khanfar, Mohammad A.. "Oxadiazol-based mTOR inhibitors with potent antiproliferative activities: synthetic and computational modeling". . . Retrieved 2022/01/11.
• 2、 Baykov, S. V.,Kotlyarova, V. D.,Shetnev, A. A.,Tarasenko, M. V.. "2-(1,2,4-Oxadiazol-5-yl)anilines Based on Amidoximes and Isatoic Anhydrides: Synthesis and Structure Features". . p. 768 - 778. Retrieved 2021/06/26.