2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic acid

Base Information

Chemical Name:2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic acid
CAS No.:885273-01-8
Molecular Formula:C17H23 Cl N2 O4
Molecular Weight:354.834
Hs Code.:2933599590
DSSTox Substance ID:DTXSID901142422
Mol file:885273-01-8.mol

Synonyms:885273-01-8;2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic acid;2-(4-chlorophenyl)-2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]acetic Acid;2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)acetic acid;2-(4-Boc-piperazinyl)-2-(4-chlorophenyl)acetic acid;4-[Carboxy-(4-Chloro-Phenyl)-Methyl]-Piperazine-1-Carboxylic Acid Tert-Butyl Ester Hydrochloride;a-(4-Chlorophenyl)-4-Boc-1-piperazineacetic acid;SCHEMBL12371643;DTXSID901142422;MFCD06659337;AKOS015949733;AM804789;PS-12751;EN300-1071732;alpha-(4-Chlorophenyl)-4-Boc-1-piperazineacetic acid;2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)aceticacid;2-{4-[(tert-butoxy)carbonyl]piperazin-1-yl}-2-(4-chlorophenyl)acetic acid;1-Piperazineaceticacid, a-(4-chlorophenyl)-4-[(1,1-dimethylethoxy)carbonyl]-;alpha-(4-Chlorophenyl)-4-[(1,1-dimethylethoxy)carbonyl]-1-piperazineacetic acid

Suppliers and Price of 2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic 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

SynQuest Laboratories
a-(4-Chlorophenyl)-4-Boc-1-piperazineacetic acid
1 g
$ 1056.00

Crysdot
2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)aceticacid 97%
5g
$ 1348.00

Crysdot
2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)aceticacid 97%
1g
$ 449.00

American Custom Chemicals Corporation
4-[CARBOXY-(4-CHLORO-PHENYL)-METHYL]-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER HYDROCHLORIDE 95.00%
5MG
$ 504.21

Alichem
2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)aceticacid
1g
$ 505.62

Alichem
2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)aceticacid
250mg
$ 191.00

Alichem
2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)aceticacid
5g
$ 1444.30

Acrotein
a-(4-Chlorophenyl)-4-Boc-1-piperazineaceticacid 97%
5g
$ 550.00

Total 5 raw suppliers

Chemical Property of 2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic acid

Chemical Property:

PSA：70.08000
LogP:3.69620
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:354.1346349
Heavy Atom Count:24
Complexity:450

Purity/Quality:

97% ^*data from raw suppliers

a-(4-Chlorophenyl)-4-Boc-1-piperazineacetic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)OC(=O)N1CCN(CC1)C(C2=CC=C(C=C2)Cl)C(=O)O

Technology Process of 2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic acid

There total 5 articles about 2-(4-Boc-piperazinyl)-2-(4-chloro-phenyl)acetic 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: 43.4%

: 1266117-19-4
tert-butyl 4-(1-(4-chlorophenyl)-2-methoxy-2-oxoethyl)piperazine-1-carboxylate

: 885273-01-8
2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)acetic acid

Guidance literature:: With water; sodium hydroxide; In ethanol; for 4h;
DOI:10.1016/j.bioorg.2020.103671

Reference yield: 43.4%

: 885273-01-8
2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)acetic acid

Guidance literature:: With sodium hydroxide; In ethanol; water; at 20 ℃; for 4h;

Reference yield:

: 52449-43-1
(4-chloro-phenyl)-acetic acid methyl ester

: 885273-01-8
2-(4-(tert-butoxycarbonyl)piperazin-1-yl)-2-(4-chlorophenyl)acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile) / tetrachloromethane / 2 h / Reflux

2: N-ethyl-N,N-diisopropylamine / acetonitrile / 4 h / 80 °C

3: sodium hydroxide; water / ethanol / 4 h

With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile); water; N-ethyl-N,N-diisopropylamine; sodium hydroxide; In tetrachloromethane; ethanol; acetonitrile;
DOI:10.1016/j.bioorg.2020.103671