5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one

Base Information

Chemical Name:5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one
CAS No.:4399-40-0
Molecular Formula:C13H16N2OS
Molecular Weight:248.349
Hs Code.:2933990090
European Community (EC) Number:224-529-3
NSC Number:96424
DSSTox Substance ID:DTXSID101207880
Nikkaji Number:J130.664B
Mol file:4399-40-0.mol

Synonyms:Pth-leucine;4399-40-0;PTH-DL-Leucine;5-Isobutyl-3-phenyl-2-thioxoimidazolidin-4-one;5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one;5-(2-methylpropyl)-3-phenyl-2-sulfanylideneimidazolidin-4-one;Hydantoin, 5-isobutyl-3-phenyl-2-thio-;Leucine 3-phenyl-2-thiohydantoin;EINECS 224-529-3;2-Thio-5-isobutyl-3-phenylhydantoin;4-Imidazolidinone, 5-(2-methylpropyl)-3-phenyl-2-thioxo-;NSC96424;5-Isobutyl-3-phenyl-2-thioxo-4-imidazolidinone #;SCHEMBL110306;FMVWVPAXPVSWER-UHFFFAOYSA-N;DTXSID101207880;Leucine, 3-phenyl-2-thiohydantoin;5-Isobutyl-3-phenyl-2-thiohydantoin;CCG-25890;NSC 96424;NSC-96424;STK722015;AKOS000637308;AS-81703;CS-0367210;FT-0635272;P0377;E78944;A826472;SR-01000516011;SR-01000516011-1;5-(2-Methylpropyl)-3-phenyl-2-thioxo-4-imidazolidinone;5-isobutyl-3-phenyl-2-thioxotetrahydro-4H-imidazol-4-one

Suppliers and Price of 5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one

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

Chem-Impex
Phenylthiohydantoin-leucine,≥98%(HPLC) ≥98%(HPLC)
1G
$ 31.20

American Custom Chemicals Corporation
PHENYLTHIOHYDANTOIN-LEUCINE 95.00%
100MG
$ 138.50

American Custom Chemicals Corporation
PHENYLTHIOHYDANTOIN-LEUCINE 95.00%
1G
$ 737.42

AHH
PTH-DL-Leucine 98%
5g
$ 488.00

Total 16 raw suppliers

Chemical Property of 5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one

Chemical Property:

Vapor Pressure:0.0001mmHg at 25°C
Melting Point:180oC
Boiling Point:338.1oC at 760 mmHg
Flash Point:158.3oC
PSA：64.43000
Density:1.21g/cm3
LogP:2.71620
Storage Temp.:−20°C
XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:248.09833431
Heavy Atom Count:17
Complexity:311

Purity/Quality:

97% ^*data from raw suppliers

Phenylthiohydantoin-leucine,≥98%(HPLC) ≥98%(HPLC) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CC(C)CC1C(=O)N(C(=S)N1)C2=CC=CC=C2

Technology Process of 5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one

There total 18 articles about 5-(2-Methylpropyl)-3-phenyl-2-thioxoimidazolidin-4-one 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: 80.0%

: 701-73-5
methyl N-phenyldithiocarbamate

: 328-39-2,21675-61-6,25248-98-0,70-45-1
LEUCINE

: 4399-40-0
5-isobutyl-3-phenyl-2-thioxo-imidazolidin-4-one

Guidance literature:: With triethylamine; In ethanol; for 5h; Heating;
DOI:10.1055/s-1983-30349

Reference yield: 70.0%

: 103-72-0
phenyl isothiocyanate

: 328-39-2,21675-61-6,25248-98-0,70-45-1
LEUCINE

: 4399-40-0
5-isobutyl-3-phenyl-2-thioxo-imidazolidin-4-one

Guidance literature:: phenyl isothiocyanate; LEUCINE; With triethylamine; In 1,4-dioxane; water; at 0 ℃;

With hydrogenchloride; In 1,4-dioxane; water; at 0 - 50 ℃; for 12h; pH=Ca. 2;
DOI:10.1002/chem.201800506

Reference yield:

: 85915-91-9
2-(2'-Methylpropyl)-5-phenylthiohydantoic acid

: 4399-40-0
5-isobutyl-3-phenyl-2-thioxo-imidazolidin-4-one

Guidance literature:: With hydrogenchloride; In 1,4-dioxane; water; at 0 - 160 ℃; for 0.0333333h; pH=Ca. 2; Microwave irradiation; Sealed tube;
DOI:10.5012/bkcs.2014.35.12.3609