3-(Benzyl((benzyloxy)carbonyl)amino)propanoic acid

Base Information

Chemical Name:3-(Benzyl((benzyloxy)carbonyl)amino)propanoic acid
CAS No.:252919-08-7
Molecular Formula:C18H19NO4
Molecular Weight:313.353
Hs Code.:2924299090
DSSTox Substance ID:DTXSID60573962
Nikkaji Number:J3.178.181G
Wikidata:Q72502202
Mol file:252919-08-7.mol

Synonyms:252919-08-7;N-Benzyl-N-Cbz-beta-alanine;3-(Benzyl((benzyloxy)carbonyl)amino)propanoic acid;N-Cbz-N-Bzl-Beta-Alanine;N-[(Phenylmethoxy)carbonyl]-N-(phenylmethyl)-beta-alanine;3-{benzyl[(benzyloxy)carbonyl]amino}propanoic acid;3-[benzyl(phenylmethoxycarbonyl)amino]propanoic acid;MFCD19703280;FD1043;SCHEMBL2195997;DTXSID60573962;RGNBASLLMGVXSF-UHFFFAOYSA-N;CKA91908;AKOS016004586;FS-4238;AC-23827;SY017556;CS-0156316;N-Benzyl-N-[(benzyloxy)carbonyl]-beta-alanine;3-(benzyl-benzyloxycarbonyl-amino)propanoic acid;EN300-7048589;3-{benzyl[(benzyloxy)cabonyl]amino}propanoic acid

Suppliers and Price of 3-(Benzyl((benzyloxy)carbonyl)amino)propanoic 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
N-Cbz-N-Bzl-β-Alanine
100mg
$ 60.00

TRC
N-Cbz-N-Bzl-β-Alanine
50mg
$ 45.00

TRC
N-Cbz-N-Bzl-β-Alanine
500mg
$ 75.00

SynQuest Laboratories
N-Benzyl-N-Cbz-beta-alanine
1 g
$ 180.00

Crysdot
3-(Benzyl((benzyloxy)carbonyl)amino)propanoicacid 95+%
5g
$ 35.00

Crysdot
3-(Benzyl((benzyloxy)carbonyl)amino)propanoicacid 95+%
10g
$ 64.00

Crysdot
3-(Benzyl((benzyloxy)carbonyl)amino)propanoicacid 95+%
25g
$ 134.00

Ambeed
N-Benzyl-N-Cbz-beta-alanine 97%
25g
$ 87.00

Ambeed
N-Benzyl-N-Cbz-beta-alanine 97%
10g
$ 38.00

Ambeed
N-Benzyl-N-Cbz-beta-alanine 97%
5g
$ 21.00

Total 21 raw suppliers

Chemical Property of 3-(Benzyl((benzyloxy)carbonyl)amino)propanoic acid

Chemical Property:

Boiling Point:506.8±49.0 °C(Predicted)
PKA:4.45±0.10(Predicted)
PSA：66.84000
Density:1.232
LogP:3.30010
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:313.13140809
Heavy Atom Count:23
Complexity:373

Purity/Quality:

97% ^*data from raw suppliers

N-Cbz-N-Bzl-β-Alanine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CN(CCC(=O)O)C(=O)OCC2=CC=CC=C2

Technology Process of 3-(Benzyl((benzyloxy)carbonyl)amino)propanoic acid

There total 4 articles about 3-(Benzyl((benzyloxy)carbonyl)amino)propanoic 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: 90.0%

: 2304-94-1
3-(benzyloxycarbonylamino)propanoic acid

: 100-39-0
benzyl bromide

: 252919-08-7
3-{benzyl[(benzyloxy)carbonyl]amino}propanoic acid

Guidance literature:: With sodium hydride; In tetrahydrofuran; N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1021/jo016086b

Reference yield:

: 1254985-66-4
C₁₉H₂₁NO₄

: 252919-08-7
3-{benzyl[(benzyloxy)carbonyl]amino}propanoic acid

Guidance literature:: C₁₉H₂₁NO₄; With sodium hydroxide; In methanol; water; at 20 ℃; for 2h;

With hydrogenchloride; In water;
DOI:10.1055/s-0032-1318107

Reference yield:

: 100-46-9
benzylamine

: 252919-08-7
3-{benzyl[(benzyloxy)carbonyl]amino}propanoic acid

Guidance literature:: Multi-step reaction with 3 steps

1.1: 1,8-diazabicyclo[5.4.0]undec-7-ene / 12.25 h / 0 - 20 °C

2.1: triethylamine / dichloromethane / 0 °C

2.2: 12 h / 0 - 20 °C

3.1: sodium hydroxide / water; methanol / 2 h / 20 °C

With 1,8-diazabicyclo[5.4.0]undec-7-ene; triethylamine; sodium hydroxide; In methanol; dichloromethane; water;
DOI:10.1055/s-0032-1318107