4-[(4-Fluorobenzyl)amino]benzoic acid

Base Information

Chemical Name:4-[(4-Fluorobenzyl)amino]benzoic acid
CAS No.:64260-96-4
Molecular Formula:C14H12FNO2
Molecular Weight:245.253
Hs Code.:2922499990
DSSTox Substance ID:DTXSID40356816
Wikidata:Q82136399
Mol file:64260-96-4.mol

Synonyms:4-[(4-fluorobenzyl)amino]benzoic acid;64260-96-4;4-((4-Fluorobenzyl)amino)benzoic acid;4-[(4-fluorophenyl)methylamino]benzoic acid;AN-465/41988482;SCHEMBL1663181;DTXSID40356816;MFCD04150789;STK510789;4-((4-Fluorobenzyl)amino)benzoicacid;AKOS000284611;SB81071;NCGC00340159-01;BS-38226;CS-0326744;AB00339392-04;Z57328589

Suppliers and Price of 4-[(4-Fluorobenzyl)amino]benzoic 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

ChemBridge Corporation
4-[(4-fluorobenzyl)amino]benzoicacid 95%
1 g
$ 46.00

American Custom Chemicals Corporation
4-[(4-FLUOROBENZYL)AMINO]BENZOIC ACID 95.00%
10G
$ 3122.84

American Custom Chemicals Corporation
4-[(4-FLUOROBENZYL)AMINO]BENZOIC ACID 95.00%
250MG
$ 626.01

Total 4 raw suppliers

Chemical Property of 4-[(4-Fluorobenzyl)amino]benzoic acid

Chemical Property:

Vapor Pressure:8E-08mmHg at 25°C
Boiling Point:420.5oC at 760 mmHg
Flash Point:208.1oC
PSA：49.33000
Density:1.316g/cm3
LogP:3.20900
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:245.08520679
Heavy Atom Count:18
Complexity:269

Purity/Quality:

99% ^*data from raw suppliers

4-[(4-fluorobenzyl)amino]benzoicacid 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1CNC2=CC=C(C=C2)C(=O)O)F

Technology Process of 4-[(4-Fluorobenzyl)amino]benzoic acid

There total 1 articles about 4-[(4-Fluorobenzyl)amino]benzoic 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%

: 459-57-4
4-fluorobenzaldehyde

: 150-13-0,159246-81-8,8014-65-1
4-amino-benzoic acid

: 64260-96-4
4-((4-fluorobenzyl)amino)benzoic acid

Guidance literature:: With 2-picoline borane complex; In methanol; at 20 ℃; for 14h; Inert atmosphere;
DOI:10.1016/j.bmc.2012.09.053

Reference yield: 92.0%

: 28920-43-6
(fluorenylmethoxy)carbonyl chloride

: 64260-96-4
4-((4-fluorobenzyl)amino)benzoic acid

: 1444605-60-0
4-((((9H-fluoren-9-yl)methoxy)carbonyl)(4-fluorobenzyl)amino)benzoic acid

Guidance literature:: In tetrahydrofuran; chloroform; Reflux;
DOI:10.1016/j.bmc.2012.09.053

Reference yield:

: 64260-96-4
4-((4-fluorobenzyl)amino)benzoic acid

: C₂₉H₂₁ClFNO₃

Guidance literature:: Multi-step reaction with 2 steps

1: chloroform; tetrahydrofuran / Reflux

2: 1-chloro-1-(dimethylamino)-2-methyl-1-propene / chloroform / 1 h / 20 °C

With 1-chloro-1-(dimethylamino)-2-methyl-1-propene; In tetrahydrofuran; chloroform;
DOI:10.1016/j.bmc.2012.09.053