4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

Base Information

Chemical Name:4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid
CAS No.:651734-52-0
Molecular Formula:C16H15F2NO4
Molecular Weight:323.296
Hs Code.:
DSSTox Substance ID:DTXSID70593838
Wikidata:Q82488432
Mol file:651734-52-0.mol

Synonyms:4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid;651734-52-0;SCHEMBL4405351;DTXSID70593838;WJARTJXTFKFRFB-UHFFFAOYSA-N;BBB73452;Benzoic acid, 3,5-difluoro-2,6-dimethoxy-4-[(phenylmethyl)amino]-;MFCD29047016;AKOS025402607;DS-8923;SY272249;DB-395764;CS-0162696;C76040;A867728;4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid;4-(Benzylamino)-3 pound not5-difluoro-2 pound not6-dimethoxybenzoic acid

Suppliers and Price of 4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic 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

Crysdot
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid 95+%
1g
$ 1250.00

Alichem
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid
5g
$ 727.65

Alichem
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid
1g
$ 282.15

AK Scientific
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid
1g
$ 91.00

AK Scientific
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid
250mg
$ 85.00

Abosyn
4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid 95-98%
1g
$ 340.00

Total 7 raw suppliers

Chemical Property of 4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

Chemical Property:

PSA：67.79000
LogP:3.36530
Storage Temp.:Keep in dark place,Inert atmosphere,Room temperature
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:323.09691428
Heavy Atom Count:23
Complexity:374

Purity/Quality:

97% ^*data from raw suppliers

4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoicacid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C(=C(C(=C1F)NCC2=CC=CC=C2)F)OC)C(=O)O

Technology Process of 4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

There total 5 articles about 4-(Benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic 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: 86.0%

: 122590-82-3
methyl N-benzyl-4-amino-2,3,5,6-tetrafluorobenzoate

: 124-41-4
sodium methylate

: 651734-52-0
4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

Guidance literature:: In methanol; at 20 - 70 ℃; for 21h; Inert atmosphere; Large scale;

Reference yield:

: 36629-42-2
methyl pentafluorobenzoate

: 651734-52-0
4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: N-ethyl-N,N-diisopropylamine / 1-methyl-pyrrolidin-2-one / 4.5 h / 50 - 65 °C / Large scale

2: methanol / 21 h / 20 - 70 °C / Inert atmosphere; Large scale

With N-ethyl-N,N-diisopropylamine; In 1-methyl-pyrrolidin-2-one; methanol;

Reference yield:

: 651734-51-9
methyl 4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoate

: 651734-52-0
4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoic acid

Guidance literature:: methyl 4-(benzylamino)-3,5-difluoro-2,6-dimethoxybenzoate; With sodium hydroxide; water; In ethanol; at 10 - 55 ℃;

With hydrogenchloride; In ethanol; water; at 0 ℃; pH=2;