4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde

Base Information

• Chemical Name: 4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde
• CAS No.: 29947-17-9
• Molecular Formula: C11H7 N O2 S2
• Molecular Weight: 249.314
• NSC Number: 80710
• DSSTox Substance ID: DTXSID90422055
• Wikidata: Q82233834
• Mol file: 29947-17-9.mol

Synonyms:NSC80710;29947-17-9;4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde;SCHEMBL12961168;DTXSID90422055;NSC-80710;AKOS001376590

Chemical Property of 4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.48g/cm³
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 248.99182081
• Heavy Atom Count: 16
• Complexity: 357

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=C2C(=O)NC(=S)S2)C=O
• Isomeric SMILES: C1=CC(=CC=C1/C=C\2/C(=O)NC(=S)S2)C=O

Technology Process of 4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde

There total 1 articles about 4-[(Z)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzaldehyde 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:

2-thioxo-4-thiazolidinone (141-84-4) + terephthalaldehyde, (623-27-8) → 4-(4-oxo-2-thioxo-thiazolidin-5-ylidenemethyl)benzaldehyde (29947-17-9)

Guidance literature:

With potassium acetate; acetic anhydride; In n-heptane; acetic acid; Heating;

Reference yield: 63.0%

[4-(3-aminophenyl)-8-(trifluoromethyl)quinolin-3-yl](phenyl)methanone (854765-99-4) + 4-(4-oxo-2-thioxo-thiazolidin-5-ylidenemethyl)benzaldehyde (29947-17-9) → 5-{4-[({3-[3-benzoyl-8-(trifluoromethyl)quinolin-4-yl]phenyl}amino)methyl]benzylidene}-2-thioxo-1,3-thiazolidin-4-one

Guidance literature:

With sodium tris(acetoxy)borohydride; acetic acid; In acetonitrile; at 45 ℃; for 1h;

DOI:10.1016/j.bmc.2007.03.013

upstream raw materials:

2-thioxo-4-thiazolidinone

terephthalaldehyde,