Cambridge id 6124556

Base Information

• Chemical Name: Cambridge id 6124556
• CAS No.: 6124-55-6
• Molecular Formula: C₁₂H₈FNO₅S
• Molecular Weight: 297.264
• DSSTox Substance ID: DTXSID50976746
• Wikidata: Q82961722
• ChEMBL ID: CHEMBL1569565
• Mol file: 6124-55-6.mol

Synonyms:6124-55-6;SMR000106114;CBMicro_031363;Cambridge id 6124556;Oprea1_480938;MLS000110183;CHEMBL1569565;DTXSID50976746;HMS2379C03;AKOS001321931;BIM-0031360.P001;Z89295675;N-(2-Ethyl-6-methylphenyl)-2-methylfuran-3-carboximidic acid

Chemical Property of Cambridge id 6124556

Chemical Property:

• Vapor Pressure: 0.002mmHg at 25°C
• Boiling Point: 291°Cat760mmHg
• Flash Point: 129.8°C
• Density: 1.123g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 243.125928785
• Heavy Atom Count: 18
• Complexity: 292

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC=CC(=C1NC(=O)C2=C(OC=C2)C)C

Technology Process of Cambridge id 6124556

There total 1 articles about Cambridge id 6124556 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:

→ 3-Nitro-benzolsulfonsaeure-<4-fluor-phenylester> (6124-55-6)

Guidance literature:

Aus 4-Fluor-phenol und 3-Nitro-benzolsulfonylchlorid in A. mit Natriumaethylat;

DOI:10.1021/jo01339a032