PHENYLTHIOHYDANTOIN ASPARTIC ACID)

Base Information

• Chemical Name: PHENYLTHIOHYDANTOIN ASPARTIC ACID)
• CAS No.: 29588-04-3
• Molecular Formula: C11H10 N2 O3 S
• Molecular Weight: 250.278
• Hs Code.: 2933990090
• Mol file: 29588-04-3.mol

Synonyms:4-Imidazolidineaceticacid, 5-oxo-1-phenyl-2-thioxo-, (S)-; 4-Imidazolidineacetic acid, 5-oxo-1-phenyl-2-thioxo-,L- (8CI); Aspartic acid phenylthiohydantoin; L-Aspartic acidphenylthiohydantoin; PTH-L-aspartic acid; Phenylthiohydantoin L-aspartic acid

Chemical Property of PHENYLTHIOHYDANTOIN ASPARTIC ACID)

Chemical Property:

• Vapor Pressure: 2.43E-08mmHg at 25°C
• Melting Point: approximate 235℃
• Refractive Index: 1.705
• Boiling Point: 435.1°C at 760 mmHg
• Flash Point: 216.9°C
• PSA: 101.73000
• Density: 1.51g/cm³
• LogP: 1.14480

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of PHENYLTHIOHYDANTOIN ASPARTIC ACID)

There total 3 articles about PHENYLTHIOHYDANTOIN ASPARTIC ACID) 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: 95.0%

L-Aspartic acid (56-84-8,25608-40-6,27881-03-4,32505-46-7,52526-39-3) + phenyl isothiocyanate (103-72-0) → 2-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)acetic acid (29588-04-3)

Guidance literature:

With triethylamine; In water; N,N-dimethyl-formamide; at 20 ℃; for 6h;

DOI:10.1080/00397911.2015.1052506

Reference yield:

phenyl thioisocyanate (49645-33-2) + secretory phospholipase A2 from Crotalus durissus cascavella venom modified with naringin → 3-phenyl-2-thioxoimidazolidin-4-one (2010-15-3) + hexahydro-2-phenyl-3-thioxopyrrolo[1,2-c]imidazol-1-one (29635-99-2) + C13H12N4OS + (S)-5-(4-hydroxy-benzyl)-3-phenyl-2-thioxo-imidazolidin-4-one (29588-08-7) + 5-(hydroxymethyl)-3-phenyl-2-thioxoimidazolidin-4-one (29635-84-5) + 2-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)acetic acid (29588-04-3) + L-arginine N-phenylthiohydantoin (29635-93-6) + (S)-5-methyl-3-phenyl-2-thioxoimidazolidin-4-one (7390-20-7) + 3-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)propanoic acid (7390-22-9) + 5-(1-hydroxyethyl)-3-phenyl-2-thioxoimidazolidin-4-one

Guidance literature:

secretory phospholipase A₂ from Crotalus durissus cascavella venom modified with naringin; With hydrogenchloride; phenol; In water; at 106 ℃; for 24h;

phenyl thioisocyanate; With triethylamine; In ethanol; water;

DOI:10.3390/molecules16010738

Reference yield:

phenyl thioisocyanate (49645-33-2) + secretory phospholipase A2 from Crotalus durissus cascavella venom → 5-(4-aminobutyl)-3-phenyl-2-thioxoimidazolidin-4-one (29912-57-0) + 3-phenyl-2-thioxoimidazolidin-4-one (2010-15-3) + 5-(mercaptomethyl)-3-phenyl-2-thioxoimidazolidin-4-one (51782-70-8,5789-26-4) + (S)-5-((S)-sec-butyl)-3-phenyl-2-thioxoimidazolidin-4-one (29583-07-1) + (S)-5-isopropyl-3-phenyl-2-thioxoimidazolidin-4-one (29635-81-2) + 5-[2-(methylthio)ethyl]-3-phenyl-2-thioxoimidazolidin-4-one (29583-09-3) + 2-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)acetic acid (29588-04-3) + (S)-5-((1H-indol-3-yl)methyl)-3-phenyl-2-thioxoimidazolidin-4-one (29635-97-0) + 5-isobutyl-3-phenyl-2-thioxoimidazolidin-4-one + (S)-5-benzyl-3-phenyl-2-thioxoimidazolidin-4-one (29588-07-6)

Guidance literature:

secretory phospholipase A₂ from Crotalus durissus cascavella venom; With hydrogenchloride; phenol; In water; at 106 ℃; for 24h;

phenyl thioisocyanate; With triethylamine; In ethanol; water;

DOI:10.3390/molecules16010738

upstream raw materials:

phenyl thioisocyanate

L-Aspartic acid

phenyl isothiocyanate

Downstream raw materials:

(S)-N-Methyl-3-(3-phenyl-thioureido)-succinamic acid; compound with methylamine

Refernces

• 1、 Santos, Marcelo L.,Toyama, Daniela O.,Oliveira, Simone C. B.,Cotrim, Camila A.,Diz-Filho, Eduardo B. S.,Fagundes, Fabio H. R.,Soares, Veronica C. G.,Aparicio, Ricardo,Toyama, Marcos H.. "Modulation of the pharmacological activities of secretory phospholipase A2 from Crotalus durissus cascavella induced by naringin". experimental part. p. 738 - 761. Retrieved 2011/04/15.