3-Phenyl-2-thiohydantoin-5-acetic acid

Base Information

Chemical Name:3-Phenyl-2-thiohydantoin-5-acetic acid
CAS No.:5624-13-5
Molecular Formula:C11H10 N2 O3 S
Molecular Weight:250.278
Hs Code.:2933990090
European Community (EC) Number:227-055-5
DSSTox Substance ID:DTXSID70971672
Nikkaji Number:J208.851G
ChEMBL ID:CHEMBL1574009
Mol file:5624-13-5.mol

Synonyms:5624-13-5;Pth-aspartic acid;3-Phenyl-2-thiohydantoin-5-acetic acid;Aspartic phenylthiohydantoin;Phenylthiohydantoin-aspartic Acid;Aspartic acid phenylthiohydantoin;2-(5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl)acetic acid;2-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)acetic acid;EINECS 227-055-5;5-Oxo-1-phenyl-2-thioxo-4-imidazolidineacetic acid;4-IMIDAZOLIDINEACETIC ACID, 5-OXO-1-PHENYL-2-THIOXO-;5-Oxo-1-phenyl-2-thioxoimidazolidine-4-acetic acid;5-Hydantoinacetic acid, 3-phenyl-2-thio-;CBMicro_034881;Aspartate phenylthiohydantoin;Oprea1_377095;MLS000550870;CHEMBL1574009;DTXSID70971672;NFUCNAREVSTFNC-UHFFFAOYSA-N;HMS2464F24;STK700346;AKOS001668544;NCGC00246441-01;LS-79013;SMR000144998;BIM-0034882.P001;CS-0453618;P0364;5-Hydantoinacetic acid, 3-phenyl-2-thio- (6CI);SR-01000458672;SR-01000458672-1;(5-Oxo-1-phenyl-2-thioxo-4-imidazolidinyl)acetic acid;(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)acetic acid;2-(5-oxo-1-phenyl-2-thioxoimidazolidin-4-yl)aceticacid;(5-Oxo-1-phenyl-2-thioxo-4-imidazolidinyl)acetic acid #;(5-Oxo-1-phenyl-2-thioxo-imidazolidin-4-yl)-acetic acid;(5-Oxo-1-phenyl-2-sulfanyl-4,5-dihydro-1H-imidazol-4-yl)acetic acid

Suppliers and Price of 3-Phenyl-2-thiohydantoin-5-acetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Phenylthiohydantoin-aspartic Acid
2mg
$ 60.00

TRC
Phenylthiohydantoin-aspartic Acid
10mg
$ 75.00

TCI Chemical
Phenylthiohydantoin-aspartic Acid >95.0%(T)
1g
$ 71.00

TCI Chemical
Phenylthiohydantoin-aspartic Acid >95.0%(T)
100mg
$ 28.00

Chem-Impex
Phenylthiohydantoin-asparticacid,95%(Assaybytitration) 95%(Assaybytitration)
100MG
$ 23.52

Chem-Impex
Phenylthiohydantoin-asparticacid,≥95%(Assaybytitration) ≥95%(Assaybytitration)
1G
$ 76.88

American Custom Chemicals Corporation
PHENYLTHIOHYDANTOIN-ASPARTIC ACID 95.00%
1G
$ 710.43

American Custom Chemicals Corporation
PHENYLTHIOHYDANTOIN-ASPARTIC ACID 95.00%
250MG
$ 210.00

AK Scientific
Phenylthiohydantoin-aspartic Acid
100mg
$ 102.00

Total 13 raw suppliers

Chemical Property of 3-Phenyl-2-thiohydantoin-5-acetic acid

Chemical Property:

Vapor Pressure:2.43E-08mmHg at 25°C
Melting Point:233-234 °C(Solv: ethanol (64-17-5))
Boiling Point:435.1°Cat760mmHg
PKA:3.94±0.10(Predicted)
Flash Point:216.9°C
PSA：101.73000
Density:1.51g/cm³
LogP:1.14480
Storage Temp.:−20°C
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:250.04121336
Heavy Atom Count:17
Complexity:353

Purity/Quality:

98%,99%, ^*data from raw suppliers

Phenylthiohydantoin-aspartic Acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)N2C(=O)C(NC2=S)CC(=O)O

Technology Process of 3-Phenyl-2-thiohydantoin-5-acetic acid

There total 7 articles about 3-Phenyl-2-thiohydantoin-5-acetic 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:

: 103-72-0
phenyl isothiocyanate

: 5624-13-5
acide 3-phenyl 2-thio-5-hydantoine acetique

Guidance literature:: Multi-step reaction with 2 steps

1: 1 N KOH / ethanol / 2 h / 40 °C

2: ethanol / 0.25 h / Heating; pH 1

With potassium hydroxide; In ethanol;
DOI:10.1016/0223-5234(92)90011-O