3-(Benzylamino)hexanoic acid

Base Information

Chemical Name:3-(Benzylamino)hexanoic acid
CAS No.:93620-38-3
Molecular Formula:C13H19NO2
Molecular Weight:221.29500
Hs Code.:
DSSTox Substance ID:DTXSID60526953
Nikkaji Number:J45.050B

Synonyms:3-(BENZYLAMINO)HEXANOIC ACID;93620-38-3;3-(Benzylamino)caproic acid;SCHEMBL4883935;DTXSID60526953

Suppliers and Price of 3-(Benzylamino)hexanoic 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

Labseeker
3-(benzylamino)hexanoicacid 95
25g
$ 3245.00

American Custom Chemicals Corporation
3-(BENZYLAMINO)HEXANOIC ACID 95.00%
5MG
$ 496.22

Total 0 raw suppliers

Chemical Property of 3-(Benzylamino)hexanoic acid

Chemical Property:

PSA：49.33000
LogP:2.81050
XLogP3:-0.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:221.141578849
Heavy Atom Count:16
Complexity:200

Purity/Quality:: 3-(benzylamino)hexanoicacid 95 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCC(CC(=O)O)NCC1=CC=CC=C1

Technology Process of 3-(Benzylamino)hexanoic acid

There total 4 articles about 3-(Benzylamino)hexanoic 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: 97.0%

: rac-methyl 3-(benzylamino)hexanoate

: 93620-38-3
rac-3-(N-benzylamino)hexanoic acid

Guidance literature:: With water; sodium hydroxide; for 4h; Reflux;
DOI:10.3762/bjoc.13.167

Reference yield:

: 13419-69-7
(E)-2-Hexenoic acid

: 100-46-9
benzylamine

: 93620-38-3
rac-3-(N-benzylamino)hexanoic acid

Guidance literature:: With pyridine; at 120 - 130 ℃; for 3h;
DOI:10.1016/S0957-4166(01)00002-7

Reference yield:

: 100-46-9
benzylamine

: 93620-38-3
rac-3-(N-benzylamino)hexanoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: bismuth (III) nitrate pentahydrate / 0.08 h / 0 °C

2: water; sodium hydroxide / 4 h / Reflux

With bismuth (III) nitrate pentahydrate; water; sodium hydroxide;
DOI:10.3762/bjoc.13.167