Acetone O-carbaniloyloxime

Base Information

• Chemical Name: Acetone O-carbaniloyloxime
• CAS No.: 2828-42-4
• Molecular Formula: C10H12 N2 O2
• Molecular Weight: 192.217
• Hs Code.: 2928000090
• European Community (EC) Number: 220-591-0
• NSC Number: 61379,5607
• UNII: 43W8J9PAIK
• DSSTox Substance ID: DTXSID70182529
• Nikkaji Number: J7.917K
• Wikidata: Q27258676
• Mol file: 2828-42-4.mol

Synonyms:O-(N-phenylcarbamoyl)propanoxime;proximphan

Chemical Property of Acetone O-carbaniloyloxime

Chemical Property:

• Refractive Index: 1.7110 (estimate)
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 50.69000
• Density: 1.08g/cm³
• LogP: 2.70390
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 192.089877630
• Heavy Atom Count: 14
• Complexity: 216

Purity/Quality:

99.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=NOC(=O)NC1=CC=CC=C1)C

Technology Process of Acetone O-carbaniloyloxime

There total 18 articles about Acetone O-carbaniloyloxime 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%

acetone (67-64-1) + O-phenylcarbamoylhydroxylammonium tosylate → O-(Phenylcarbamoyl)acetonoxim (2828-42-4)

Guidance literature:

for 0.25h; Ambient temperature;

DOI:10.1016/S0040-4020(98)01046-1

Reference yield: 94.0%

phenyl isocyanate (103-71-9) + acetone oxime (127-06-0) → O-(Phenylcarbamoyl)acetonoxim (2828-42-4)

Guidance literature:

In dichloromethane; for 0.5h; Ambient temperature;

DOI:10.1002/prac.19933350610

Reference yield: 86.0%

1-(1-methoxy-1-methylethoxy)-3-phenylharnstoff → O-(Phenylcarbamoyl)acetonoxim (2828-42-4)

Guidance literature:

With hydrogenchloride; In dichloromethane; for 0.0833333h; Ambient temperature;

DOI:10.1002/prac.19933350610

upstream raw materials:

phenyl isocyanate

acetone oxime

phenyl isothiocyanate

1-(1-cyano-1-methyl-ethyl)-1-hydroxy-3-phenyl-urea

Downstream raw materials:

N-Hydroxy-N-isopropyl-N'-phenylurea

N-Phenylcarbamoyloxy-isopropylamin

Refernces

• 1、 Geffken, Detlef,Froboesse, Joerg. "(O-Arylcarbamoyl)acetonoximes from 3-Aryl-1-(1-methgoxy-1-methylethoxy)ureas and 3-Aryl-1-hydroxyureas - Some Remarks on a Patent Claim". . p. 555 - 557. Retrieved 2007/10/02.
• 2、 Ketz,Zinner. "Synthesis of O-acylhydroxylamines with methyl(E)- and (Z)-acetohydroximate as protecting group". . p. 530 - 541. Retrieved 2007/10/04.