methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate

Base Information

Chemical Name:methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate
CAS No.:193287-70-6
Molecular Formula:C10H14N2O6
Molecular Weight:258.22800
Hs Code.:
DSSTox Substance ID:DTXSID00428604
Nikkaji Number:J861.059B
Wikidata:Q82241423
Mol file:193287-70-6.mol

Synonyms:193287-70-6;methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate;AC1OLRAB;DTXSID00428604

Suppliers and Price of methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate

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

Biosynth Carbosynth
Cyclo(-Asp(OMe)-Asp(OMe))
1 g
$ 1540.00

Biosynth Carbosynth
Cyclo(-Asp(OMe)-Asp(OMe))
500 mg
$ 885.00

Biosynth Carbosynth
Cyclo(-Asp(OMe)-Asp(OMe))
250 mg
$ 510.00

Biosynth Carbosynth
Cyclo(-Asp(OMe)-Asp(OMe))
100 mg
$ 255.00

Biosynth Carbosynth
Cyclo(-Asp(OMe)-Asp(OMe))
50 mg
$ 147.00

Total 2 raw suppliers

Chemical Property of methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate

Chemical Property:

PSA：117.78000
LogP:-1.35240
Storage Temp.:-15°C
XLogP3:-1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:258.08518617
Heavy Atom Count:18
Complexity:345

Purity/Quality:

HPLC>98% ^*data from raw suppliers

Cyclo(-Asp(OMe)-Asp(OMe)) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC1C(=O)NC(C(=O)N1)CC(=O)OC
Isomeric SMILES:COC(=O)C[C@H]1C(=O)N[C@H](C(=O)N1)CC(=O)OC

Technology Process of methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate

There total 1 articles about methyl 2-[(2S,5S)-5-(2-methoxy-2-oxoethyl)-3,6-dioxopiperazin-2-yl]acetate 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: 25.0%

: 32213-95-9
dimethyl L-aspartate hydrochloride

: 193287-70-6
methyl (2S,5S)-(5-methoxycarbonylmethyl-3,6-dioxopiperazin-2-yl)acetate

Guidance literature:: With ammonia; 1.) CHCl₃; 2.) 65 deg C, 5 d;
DOI:10.1016/S0040-4039(97)00961-1

Reference yield: 76.0%

: 193287-70-6
methyl (2S,5S)-(5-methoxycarbonylmethyl-3,6-dioxopiperazin-2-yl)acetate

: 5437-45-6
Benzyl bromoacetate

: 193287-68-2
methyl (2S,5S)-[1,4-bis(benzyloxycarbonylmethyl)-5-methoxycarbonylmethyl-3,6-dioxopiperazin-2-yl]acetate

Guidance literature:: With silver(l) oxide; In N,N-dimethyl-formamide; at 40 ℃; for 48h;
DOI:10.1002/(SICI)1099-0690(200004)2000:8<1669::AID-EJOC1669>3.0.CO;2-R

Reference yield:

: 193287-70-6
methyl (2S,5S)-(5-methoxycarbonylmethyl-3,6-dioxopiperazin-2-yl)acetate

: 193287-74-0
methyl (2S,5S)-{5-methoxycarbonylmethyl-3,6-dioxo-1,4-bis[(phenylmethylcarbamoyl)methyl]piperazin-2-yl}acetate

Guidance literature:: Multi-step reaction with 3 steps

1.1: 76 percent / Ag₂O / dimethylformamide / 48 h / 40 °C

2.1: 99 percent / hydrogen / Pd/C (10percent) / methanol / 12 h / 20 °C

3.1: isobutyl chloroformate; 2,6-lutidine / dimethylformamide / -15 °C

3.2: 97.3 percent / dimethylformamide / 13 h / -15 - 20 °C

With 2,6-dimethylpyridine; hydrogen; silver(l) oxide; isobutyl chloroformate; Pd/C (10percent); In methanol; N,N-dimethyl-formamide; 1.1: Alkylation / 2.1: Hydrogenolysis / 3.1: Acylation / 3.2: Acylation;
DOI:10.1002/(SICI)1099-0690(200004)2000:8<1669::AID-EJOC1669>3.0.CO;2-R