3-Anilinoalanine

Base Information

Chemical Name:3-Anilinoalanine
CAS No.:145545-23-9
Molecular Formula:C₉H₁₂N₂O₂
Molecular Weight:180.206
Hs Code.:
UNII:TD4JN22JPS
DSSTox Substance ID:DTXSID60932636
Nikkaji Number:J509.198E
Wikidata:Q82908354
Mol file:145545-23-9.mol

Synonyms:3-(phenylamino)-L-alanine;3-(phenylamino)alanine;3-anilinoalanine;3-phenylaminoalanine;PAA cpd;UV-5 compound

Suppliers and Price of 3-Anilinoalanine

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 11 raw suppliers

Chemical Property of 3-Anilinoalanine

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:406.7°Cat760mmHg
PKA:1.85±0.10(Predicted)
Flash Point:199.7°C
PSA：0.00000
Density:1.281g/cm³
LogP:0.00000
XLogP3:-1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:180.089877630
Heavy Atom Count:13
Complexity:167

Purity/Quality:: 98% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)NCC(C(=O)O)N
Isomeric SMILES:C1=CC=C(C=C1)NC[C@@H](C(=O)O)N
Uses Des-(3-Indolyl) 3-(Phenylamino) Tryptophan is the impurity of Tryptophan (T947210), which is an essential amino acid.

Technology Process of 3-Anilinoalanine

There total 10 articles about 3-Anilinoalanine 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: 92.0%

: L-2-benzyloxycarbonylamino-3-phenylaminopropionic acid

: 219638-86-5,145545-23-9
3-(phenylamino)alanine

Guidance literature:

Reference yield:

: 933453-68-0
R-(-)-2-azido-3-[benzyl(phenyl)amino]propanamide

: 145545-23-9
R-(-)-2-amino-3-(phenylamino)propanoic acid

: 145545-23-9
S-2-amino-3-(phenylamino)propanoic acid

Guidance literature:: R-(-)-2-azido-3-[benzyl(phenyl)amino]propanamide; With hydrogen; palladium on activated charcoal; In methanol; at 20 ℃; for 4h;

With hydrogenchloride; at 80 ℃; for 6h; Title compound not separated from byproducts;
DOI:10.1021/jo062339v

Reference yield:

: 933453-68-0
R-(-)-2-azido-3-[benzyl(phenyl)amino]propanamide

: 145545-23-9
R-(-)-2-amino-3-(phenylamino)propanoic acid

: 145545-23-9
S-2-amino-3-(phenylamino)propanoic acid

Guidance literature:: R-(-)-2-azido-3-[benzyl(phenyl)amino]propanamide; With hydrogen; palladium on activated charcoal; In methanol; at 20 ℃; for 4h;

With hydrogenchloride; at 80 ℃; for 6h; Title compound not separated from byproducts;
DOI:10.1021/jo062339v