Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate

Base Information

Chemical Name:Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate
CAS No.:138093-73-9
Molecular Formula:C13H18N2O4
Molecular Weight:266.297
Hs Code.:
DSSTox Substance ID:DTXSID30693646
Mol file:138093-73-9.mol

Synonyms:SCHEMBL6498057;DTXSID30693646;Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate

Suppliers and Price of Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate

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

Crysdot
(S)-Methyl2-(((benzyloxy)carbonyl)amino)-3-(methylamino)propanoate 95+%
1g
$ 451.00

Chemenu
(S)-Methyl2-(((benzyloxy)carbonyl)amino)-3-(methylamino)propanoate 95%
1g
$ 425.00

Total 5 raw suppliers

Chemical Property of Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate

Chemical Property:

PSA：80.15000
LogP:1.26910
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:266.12665706
Heavy Atom Count:19
Complexity:290

Purity/Quality:

98%min ^*data from raw suppliers

(S)-Methyl2-(((benzyloxy)carbonyl)amino)-3-(methylamino)propanoate 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNCC(C(=O)OC)NC(=O)OCC1=CC=CC=C1

Technology Process of Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate

There total 6 articles about Methyl N-[(benzyloxy)carbonyl]-3-(methylamino)alaninate 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%

: 211756-18-2
(S)-3-(2-Aza-bicyclo[2.2.1]hept-5-en-2-yl)-2-benzyloxycarbonylamino-propionic acid methyl ester

: 138093-73-9
2-benzyloxycarbonylamino-3-methylamino-propionic acid methyl ester

Guidance literature:: With triethylsilane; trifluoroacetic acid; In dichloromethane; for 2h; Ambient temperature;
DOI:10.1021/jm980071x

Reference yield:

: 35761-26-3
(S)-3-amino-2-(((benzyloxy)carbonyl)amino)propanoic acid

: 138093-73-9
2-benzyloxycarbonylamino-3-methylamino-propionic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 99 percent / HCl gas / 12 h / Ambient temperature

2: 74 percent / H₂O / 12 h / Ambient temperature

3: 95 percent / Et₃SiH, TFA / CH₂Cl₂ / 2 h / Ambient temperature

With hydrogenchloride; triethylsilane; trifluoroacetic acid; In dichloromethane; water;
DOI:10.1021/jm980071x

Reference yield:

: 58457-98-0
methyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-[(tert-butoxycarbonyl)amino]propanoate

: 138093-73-9
2-benzyloxycarbonylamino-3-methylamino-propionic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) CF₃COOH / 1.) CH₂Cl₂, RT, 20 min, 2.) H₂O, RT, 1 h

2: 344 mg / CF₃COOH, triethylsilane / CHCl₃ / 14 h / Ambient temperature

With triethylsilane; trifluoroacetic acid; In chloroform;
DOI:10.1021/ja00029a031