2-Furaldehyde thiosemicarbazone

Base Information

• Chemical Name: 2-Furaldehyde thiosemicarbazone
• CAS No.: 153750-93-7
• Molecular Formula: C6H7N3OS
• Molecular Weight: 0.00000
• European Community (EC) Number: 667-476-5
• NSC Number: 27474,9944
• UNII: MD436TU49C
• DSSTox Substance ID: DTXSID00878903
• Wikidata: Q76304766
• ChEMBL ID: CHEMBL1818876
• Mol file: 153750-93-7.mol

Synonyms:5419-96-5;2-furaldehyde thiosemicarbazone;Furfural thiosemicarbazone;[(E)-furan-2-ylmethylideneamino]thiourea;MD436TU49C;CHEMBL1818876;NSC-9944;NSC-27474;2-Furancarboxaldehyde thiosemicarbazone;2-(Furan-2-ylmethylene)hydrazinecarbothioamide;(2E)-2-(2-Furanylmethylene)hydrazinecarbothioamide;153750-93-7;2-Furaldehyde, thiosemicarbazone;Hydrazinecarbothioamide, 2-(2-furanylmethylene)-, (2E)-;Hydrazinecarbothioamide, 2-(2-furanylmethylene)-;C6-H7-N3-O-S;UNII-MD436TU49C;SCHEMBL8290549;2-furaldehyde thiose-micarbazone;DTXSID00878903;NSC9944;HMS1607B20;NSC27474;[(E)-2-furylmethyleneamino]thiourea;BDBM50350995;STK730870;AKOS000304773;2-(2-furylmethylidene)hydrazine-1-carbothioamide;(2E)-2-(furan-2-ylmethylidene)hydrazinecarbothioamide;Z49561507;HYDRAZINECARBOTHIAMIDE, 2-(2-FURANYLMETHYLENE)-

Chemical Property of 2-Furaldehyde thiosemicarbazone

Chemical Property:

• PSA: 0.00000
• LogP: 0.00000
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 169.03098303
• Heavy Atom Count: 11
• Complexity: 171

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=COC(=C1)C=NNC(=S)N
• Isomeric SMILES: C1=COC(=C1)/C=N/NC(=S)N

Technology Process of 2-Furaldehyde thiosemicarbazone

There total 7 articles about 2-Furaldehyde thiosemicarbazone 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: 96.3%

furfural (98-01-1) + thiosemicarbazide (79-19-6) → furan-2-aldehyde thiosemicarbazone (5419-96-5,153750-93-7)

Guidance literature:

In methanol; Reflux;

DOI:10.1016/j.foodchem.2015.05.124

Reference yield: 95.0%

furfural (98-01-1) + thiosemicarbazide (79-19-6) → 2-formylfuran thiosemicarbazone (153750-93-7)

Guidance literature:

With acetic acid; In water; at 30 ℃; for 0.333333h; ultrasound irradiation;

DOI:10.1016/j.tetlet.2007.12.103

Reference yield: 80.0%

furfural (98-01-1) + thiosemicarbazide (79-19-6) → (Z)-2-(furan-2-ylmethylene)hydrazinecarbothioamide (153750-93-7)

Guidance literature:

With sulfuric acid; In ethanol; for 12h; Reflux;

DOI:10.1016/j.bmc.2017.09.009

upstream raw materials:

furfural

thiosemicarbazide

2-furanaldazine

Downstream raw materials:

2-(2-(furan-2-ylmethylene)hydrazono)thiazolidin-4-one

5-furan-2-yl-[1,3,4]thiadiazol-2-ylamine

3-benzyl-2-(2-(furan-2-ylmethylene)hydrazono)thiazolidin-4-one

1-(4-(4-chlorophenyl)thiazol-2-yl)-2-(furan-2-ylmethylene)hydrazine