(S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid

Base Information

Chemical Name:(S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid
CAS No.:192725-50-1
Molecular Formula:C9H16N2O3
Molecular Weight:200.238
Hs Code.:2942000000
European Community (EC) Number:430-900-2,685-101-3
DSSTox Substance ID:DTXSID40448043
Nikkaji Number:J1.543.454F
Mol file:192725-50-1.mol

Synonyms:192725-50-1;(S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid;(2S)-(1-Tetrahydropyramid-2-one)-3-methylbutanoic acid;(2S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid;(2S)-3-METHYL-2-(2-OXO-1,3-DIAZINAN-1-YL)BUTANOIC ACID;EC 430-900-2;(S)-3-methyl-2-(2-oxotetrahydropyrimidine-1-yl)butyric acid;(2S)-3-Methyl-2-(2-oxo-tetrahydropyrimidin-1-yl)butyric acid;(s)-tetrahydro-alpha-(1-methylethyl)-2-oxo-1(2h)-pyrimidineacetic acid;SCHEMBL627916;2(S)-(1-tetrahyr- Pyramid-2-one)-3-methyl butanoic acid;DTXSID40448043;AFGBRTKUTJQHIP-ZETCQYMHSA-N;BCP12804;AKOS016007501;AC-8901;CS-T-61845;AS-76485;CS-0120686;I10429;J-501007;(S)-3-Methyl-(2-oxo-1,3-diazinan-1-yl)butanoic acid;A-164220.0;(S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoicacid;(s)-tetrahydro-a-(1-methylethyl)-2-oxo-1(2h)-pyrimidineacetic acid;(S)-Tetrahydro- alpha -(1-methylethyl)-2-oxo-1(2H)-pyrimidine-acetic Acid;(S)-Tetrahydro-?-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic Acid;1(2H)-Pyrimidineacetic acid, tetrahydro-a-(1-methylethyl)-2-oxo-, (aS)-;(2S)-3-methyl-2-(2-oxo-tetrahydro-pyrimidin-1-yl)-butyric acid, AldrichCPR;1(2H)-Pyrimidineacetic acid, tetrahydro-alpha-(1-methylethyl)-2-oxo-, (alphaS)-;1(2H)-Pyrimidineacetic acid, tetrahydro-alpha-(1-methylethyl)-2-oxo-, (S)-;(alphaS)-Tetrahydro-alpha-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic acid

Suppliers and Price of (S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic 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
(S)-Tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineaceticAcid
2.5g
$ 1355.00

Medical Isotopes, Inc.
(S)-Tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineaceticAcid
250 mg
$ 640.00

Labseeker
(2S)-(1-Tetrahydropyramid-2-one)-3-methylbutanoicacid 95
1kg
$ 738.00

Crysdot
(S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoicacid 95+%
1g
$ 377.00

American Custom Chemicals Corporation
(2S)-(1-TETRAHYDROPYRAMID-2-ONE)-3-METHYL BUTANOIC ACID 95.00%
2.5G
$ 2044.35

American Custom Chemicals Corporation
(2S)-(1-TETRAHYDROPYRAMID-2-ONE)-3-METHYL BUTANOIC ACID 95.00%
1G
$ 825.30

American Custom Chemicals Corporation
(S)-TETRAHYDRO-ALPHA-(1-METHYLETHYL)-2-OXO-1(2H)-PYRIMIDINE ACETIC ACID 95.00%
5MG
$ 496.00

American Custom Chemicals Corporation
(2S)-(1-TETRAHYDROPYRAMID-2-ONE)-3-METHYL BUTANOIC ACID 95.00%
250MG
$ 715.52

AHH
(2S)-3-Methyl-2-(2-oxo-tetrahydropyrimidin-1-yl)butyricacid 98%
10g
$ 700.00

Total 101 raw suppliers

Chemical Property of (S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.501
Boiling Point:440.793 °C at 760 mmHg
PKA:4.39±0.10(Predicted)
Flash Point:220.384 °C
PSA：69.64000
Density:1.177 g/cm³
LogP:0.77760
Storage Temp.:2-8°C
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:0.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:200.11609238
Heavy Atom Count:14
Complexity:240

Purity/Quality:

99% ^*data from raw suppliers

(S)-Tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineaceticAcid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36
Safety Statements: 26

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)C(C(=O)O)N1CCCNC1=O
Isomeric SMILES:CC(C)[C@@H](C(=O)O)N1CCCNC1=O
Uses Lopinavir (L469480) intermediate. Anti-HIV drugs Lopinavir (L469480)

Technology Process of (S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic acid

There total 12 articles about (S)-3-Methyl-2-(2-oxotetrahydropyrimidin-1(2H)-yl)butanoic 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: 75.0%

: 192725-85-2
(S)-3-Methyl-2-(2-oxo-tetrahydro-pyrimidin-1-yl)-butyric acid methyl ester

: 192725-50-1
(S)-tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic acid

Guidance literature:: With lithium hydroxide; In tetrahydrofuran; at 0 ℃; for 14h; Stirring;

Reference yield: 74.0%

: 6276-54-6
3-chloropropylamine hydrochloride

: 126147-70-4
(2S)-3-Methyl-2-(phenoxycarbonyl)aminobutyric acid

: 192725-50-1
(S)-tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic acid

Guidance literature:: With hydrogenchloride; sodium hydroxide; In tetrahydrofuran; ethanol; ethyl acetate;

Reference yield: 70.2%

: 192726-03-7
(S)-(-)-N-carboxymethyl-N(β)cyanoethyl valine

: 192725-50-1
(S)-tetrahydro-α-(1-methylethyl)-2-oxo-1(2H)-pyrimidineacetic acid

Guidance literature:: With hydrogen; nickel; potassium hydroxide; In water; at 95 ℃; for 6h; under 3000.3 - 3375.34 Torr; Reagent/catalyst; Temperature; Autoclave; Large scale;