2-(3-Amino-2,4,6-triiodophenyl)propanoic acid

Base Information

Chemical Name:2-(3-Amino-2,4,6-triiodophenyl)propanoic acid
CAS No.:21762-12-9
Molecular Formula:C9H8I3NO2
Molecular Weight:542.8787
Hs Code.:2922499990
DSSTox Substance ID:DTXSID20944371
Nikkaji Number:J51.070J
Mol file:21762-12-9.mol

Synonyms:21762-12-9;BRN 3034641;2-(3-Amino-2,4,6-triiodophenyl)propionic acid;Propionic acid, 2-(3-amino-2,4,6-triiodophenyl)-;2-(3-amino-2,4,6-triiodophenyl)propanoic acid;4-Amino-3-methoxy-benzoicacid;SCHEMBL9696073;DTXSID20944371;LS-124495;A5077

Suppliers and Price of 2-(3-Amino-2,4,6-triiodophenyl)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

Total 1 raw suppliers

Chemical Property of 2-(3-Amino-2,4,6-triiodophenyl)propanoic acid

Chemical Property:

Vapor Pressure:1.37E-11mmHg at 25°C
Boiling Point:518.8°Cat760mmHg
PKA:3.78±0.21(Predicted)
Flash Point:267.6°C
PSA：63.32000
Density:2.679g/cm³
LogP:3.85190
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:542.7689
Heavy Atom Count:15
Complexity:252

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C1=C(C(=C(C=C1I)I)N)I)C(=O)O

Technology Process of 2-(3-Amino-2,4,6-triiodophenyl)propanoic acid

There total 5 articles about 2-(3-Amino-2,4,6-triiodophenyl)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:

: 5400-78-2
1-(3-nitrophenyl)ethanol

: 21762-12-9
3-amino-2,4,6-triiodo-α-methyl-benzeneacetic acid

Guidance literature:: Multi-step reaction with 5 steps

1: aq. HBr / acetic acid

2: ethanol

3: aq. H₂SO₄

4: H₂ / Raney-Ni / ethanol

5: KICl₂, aq. HCl

With hydrogenchloride; K⁽¹⁺⁾*Cl₂I^(1-); sulfuric acid; hydrogen bromide; hydrogen; nickel; In ethanol; acetic acid;
DOI:10.1021/jm00297a057

Reference yield:

: 21762-10-7,26911-08-0,26911-09-1
(RS)-2-(3-nitrophenyl)propionic acid

: 21762-12-9
3-amino-2,4,6-triiodo-α-methyl-benzeneacetic acid

Guidance literature:: Multi-step reaction with 2 steps

1: H₂ / Raney-Ni / ethanol

2: KICl₂, aq. HCl

With hydrogenchloride; K⁽¹⁺⁾*Cl₂I^(1-); hydrogen; nickel; In ethanol;
DOI:10.1021/jm00297a057

Reference yield:

: 121-89-1
3-Nitroacetophenone

: 21762-12-9
3-amino-2,4,6-triiodo-α-methyl-benzeneacetic acid

Guidance literature:: Multi-step reaction with 6 steps

1: NaBH₄ / methanol

2: aq. HBr / acetic acid

3: ethanol

4: aq. H₂SO₄

5: H₂ / Raney-Ni / ethanol

6: KICl₂, aq. HCl

With hydrogenchloride; sodium tetrahydroborate; K⁽¹⁺⁾*Cl₂I^(1-); sulfuric acid; hydrogen bromide; hydrogen; nickel; In methanol; ethanol; acetic acid;
DOI:10.1021/jm00297a057