(2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate

Base Information

Chemical Name:(2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate
CAS No.:188777-47-1
Molecular Formula:C18H27N2O4-
Molecular Weight:335.4185
Hs Code.:2928000090
DSSTox Substance ID:DTXSID30428112
Wikidata:Q82240896
Mol file:188777-47-1.mol

Synonyms:(2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate;(2S,3S)-2-[benzyl-(tert-butoxycarbonylamino)amino]-3-methyl-pentanoate;188777-47-1;ZINC04262349;DTXSID30428112

Suppliers and Price of (2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate

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

Chemenu
(2R)-2-(1-Benzyl-2-(tert-butoxycarbonyl)hydrazinyl)-3-methylpentanoicacid 95%
1g
$ 519.00

American Custom Chemicals Corporation
(S)-(+)-NALPHA-BENZYL-NBETA-BOC-L-HYDRAZINOISOLEUCINE 95.00%
5MG
$ 502.06

Alichem
(2R)-2-(1-Benzyl-2-boc-hydrazinyl)-3-methylpentanoicacid
1g
$ 649.35

Total 7 raw suppliers

Chemical Property of (2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate

Chemical Property:

Melting Point:103-109oC
Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：78.87000
Density:g/cm³
LogP:3.81850
Storage Temp.:Refrigerator (+4°C)
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:335.19708235
Heavy Atom Count:24
Complexity:408

Purity/Quality:

98%min ^*data from raw suppliers

(2R)-2-(1-Benzyl-2-(tert-butoxycarbonyl)hydrazinyl)-3-methylpentanoicacid 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC(C)C(C(=O)[O-])N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C
Isomeric SMILES:CC[C@H](C)[C@@H](C(=O)[O-])N(CC1=CC=CC=C1)NC(=O)OC(C)(C)C

Technology Process of (2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate

There total 2 articles about (2S,3S)-2-[benzyl-[(2-methylpropan-2-yl)oxycarbonylamino]amino]-3-methylpentanoate 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%

: 1859-49-0
(2S,3S)-2-(benzylamino)-3-methylpentanoic acid

: 150884-56-3,158807-35-3
N-tert-butyloxycarbonyl-3-(4-cyanophenyl)oxaziridine

: 188777-47-1
N-benzyl-N-(tert-butoxycarbonylamino)-L-isoleucine

Guidance literature:: With tetraethylammonium hydroxide;
DOI:10.1021/jm980419o

Reference yield:

: 219547-77-0
t-butyl 3-(trichloromethyl)-1,2-oxaziridine-2-carboxylate

: (2S,3S)-2-Benzylamino-3-methyl-pentanoatetetraethyl-ammonium;

: 188777-47-1
N-benzyl-N-(tert-butoxycarbonylamino)-L-isoleucine

Guidance literature:: In dichloromethane; at -78 - 20 ℃;
DOI:10.1021/jo035700b

Reference yield: 72.0%

: 7517-19-3
methyl (L)-leucinate hydrochloride

: 188777-47-1
N-benzyl-N-(tert-butoxycarbonylamino)-L-isoleucine

: Boc-NH(Bzl)Ile-Leu-OMe

Guidance literature:: With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; triethylamine; In dichloromethane; for 18h; Ambient temperature;
DOI:10.1021/jm980419o