2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic acid

Base Information

Chemical Name:2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic acid
CAS No.:139520-43-7
Molecular Formula:C12H12 F3 N O4
Molecular Weight:291.227
Hs Code.:2924299090
DSSTox Substance ID:DTXSID10454419
Mol file:139520-43-7.mol

Synonyms:139520-43-7;2-([(BENZYLOXY)CARBONYL]AMINO)-3,3,3-TRIFLUORO-2-METHYLPROPANOIC ACID;2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid;3,3,3-trifluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoic acid;2-Amino-2-methyl-3,3,3-trifluoropropanoic acid, N-CBZ protected;2-(((Benzyloxy)carbonyl)amino)-3,3,3-trifluoro-2-methylpropanoic acid;2-(benzyloxycarbonylamino)-3,3,3-trifluoro-2-methylpropanoic acid;SCHEMBL22235482;DTXSID10454419;2-(benzyloxycarbonylamino)-3,3,3-trifluoro-2-methyl-propanoic acid;MFCD07777230;AKOS015996185;PS-11030;2--3,3,3-trifluoro-2-methyl propanoic acid;EN300-122150;A807553;2-Amino-2-methyl-3,3,3-trifluoropropanoic acid,N-CBZ protected

Suppliers and Price of 2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic 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
3,3,3-Trifluoro-2-methyl-N-[(phenylmethoxy)carbonyl]alanine
25mg
$ 110.00

SynQuest Laboratories
2-Amino-2-methyl-3,3,3-trifluoropropanoic acid, N-Cbz protected 97%
250 mg
$ 148.00

Crysdot
2-(((Benzyloxy)carbonyl)amino)-3,3,3-trifluoro-2-methylpropanoicacid 95+%
250mg
$ 339.00

Apolloscientific
2-Amino-2-methyl-3,3,3-trifluoropropanoicacid,N-CBZprotected 97%
250mg
$ 134.00

American Custom Chemicals Corporation
2-([(BENZYLOXY)CARBONYL]AMINO)-3,3,3-TRIFLUORO-2-METHYLPROPANOIC ACID 95.00%
250MG
$ 885.89

Total 11 raw suppliers

Chemical Property of 2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.494
Boiling Point:404.7°Cat760mmHg
Flash Point:198.5°C
PSA：75.63000
Density:1.376g/cm³
LogP:2.70930
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:291.07184235
Heavy Atom Count:20
Complexity:366

Purity/Quality:

97% ^*data from raw suppliers

3,3,3-Trifluoro-2-methyl-N-[(phenylmethoxy)carbonyl]alanine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36/37/39

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic acid

There total 1 articles about 2-([(Benzyloxy)carbonyl]amino)-3,3,3-trifluoro-2-methylpropanoic 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: 73.0%

: N-benzyloxycarbonyl-2(R/S)-trifluoromethylalanine methyl ester

: 139520-43-7
2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid

Guidance literature:: With potassium hydroxide; In methanol; for 24h;
DOI:10.1021/ja9067595

Reference yield: 95.0%

: 27532-96-3
glycine tert-butyl ester hydrochloride

: 139520-43-7
2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid

: 1192465-29-4
Z-CF₃-Ala-Gly-OtBu

Guidance literature:: 2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid; With N-[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylene]-dimethyl-ammonium tetrafluoroborate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.0833333h;

glycine tert-butyl ester hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; for 12h;
DOI:10.1021/ja9067595

Reference yield: 93.0%

: 13404-22-3
tert-butyl L-alaninate hydrochloride

: 139520-43-7
2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid

: 1192465-28-3
Z-CF₃-Ala-Ala-OtBu

Guidance literature:: 2-{[(benzyloxy)carbonyl]amino}-3,3,3-trifluoro-2-methylpropanoic acid; With N-[(6-chlorobenzotriazol-1-yl)oxy-(dimethylamino)methylene]-dimethyl-ammonium tetrafluoroborate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.0833333h;

tert-butyl L-alaninate hydrochloride; In N,N-dimethyl-formamide; at 20 ℃; for 12h;
DOI:10.1021/ja9067595