N'-hydroxythiophene-3-carboximidamide

Base Information

• Chemical Name: N'-hydroxythiophene-3-carboximidamide
• CAS No.: 58905-71-8
• Molecular Formula: C5H6 N2 O S
• Molecular Weight: 142.181
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID60974410
• Mol file: 58905-71-8.mol

Synonyms:Thiophene-3-carboxamidoxime;N'-hydroxythiophene-3-carboximidamide;58905-71-8;(Z)-N'-hydroxythiophene-3-carboximidamide;N-HYDROXYTHIOPHENE-3-CARBOXIMIDAMIDE;N''-HYDROXYTHIOPHENE-3-CARBOXIMIDAMIDE;Thiophene-3-amidoxime;SCHEMBL1544142;DTXSID60974410;HMS1741L19;Thiophene-3-amidoxime, AldrichCPR;3-thiophenecarboxamidine,n-hydroxy-;BBL018149;MFCD01313358;STL183451;AKOS001434020;(Z)-n'-hydroxythiophen-3-carboxamidine;CS-0036040;EN300-14476;A869327;J-502662;Z99601364

Chemical Property of N'-hydroxythiophene-3-carboximidamide

Chemical Property:

• Melting Point: 85 °C(Solv: benzene (71-43-2))
• Boiling Point: 258.7±32.0 °C(Predicted)
• PKA: 14.57±0.50(Predicted)
• Flash Point: 153.5oC
• PSA: 86.85000
• Density: 1.45±0.1 g/cm3(Predicted)
• LogP: 1.54290
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 142.02008399
• Heavy Atom Count: 9
• Complexity: 126

Purity/Quality:

98%Min ^*data from raw suppliers

N''-Hydroxythiophene-3-carboximidamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CSC=C1C(=NO)N
• Isomeric SMILES: C1=CSC=C1/C(=N/O)/N
• Uses: N''-Hydroxythiophene-3-carboximidamide

Technology Process of N'-hydroxythiophene-3-carboximidamide

There total 3 articles about N'-hydroxythiophene-3-carboximidamide 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: 99.0%

3-thiophenecarbonitrile (1641-09-4) → N-hydroxythiophene-3-formamidine (58905-71-8)

Guidance literature:

With hydroxylamine hydrochloride; sodium hydrogencarbonate; In methanol; for 5h; Reflux;

DOI:10.1021/acs.jafc.8b00507

Reference yield: 99.0%

→ N'-hydroxythiophene-3-carboximidamide (58905-71-8)

Guidance literature:

With hydroxylamine hydrochloride; sodium hydrogencarbonate; In methanol; for 5h; Reflux;

Reference yield: 82.0%

3-thiophenecarbonitrile (1641-09-4) → N'-hydroxythiophene-3-carboximidamide (58905-71-8)

Guidance literature:

With hydroxylamine hydrochloride; sodium hydrogencarbonate; In ethanol; for 6h; Reflux;

DOI:10.1016/j.tetlet.2017.08.020

upstream raw materials:

3-thiophenecarbonitrile

Downstream raw materials:

5-phenyl-3-(thiophen-3-yl)-4,5-dihydro-1,2,4-oxadiazole

3-(3-(thiophen-3-yl)-1,2,4-oxadiazol-5-yl)propanoic acid

Refernces

• 1、 Basilico, Nicoletta,Conti, Paola,Coser, Consuelo,Galbiati, Andrea,Parapini, Silvia,Tamborini, Lucia,Taramelli, Donatella,Zana, Aureliano. "Development of Potent 3-Br-isoxazoline-Based Antimalarial and Antileishmanial Compounds". supporting information. p. 1726 - 1732. Retrieved 2021/11/01.
• 2、 -. "Nortopsentin alkaloid derivatives and preparation thereof, and application of nortopsentin alkaloid derivatives to prevention and treatment of diseases and insect pests". Paragraph 0034; 0038; 0039; 0040. . Retrieved 2019/03/26.