(2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic Acid

Base Information

Chemical Name:(2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic Acid
CAS No.:140681-92-1
Molecular Formula:C₈H₁₀N₂O₃
Molecular Weight:182.179
Hs Code.:
European Community (EC) Number:895-236-1
Nikkaji Number:J1.364.691K
Wikidata:Q105345826
Mol file:140681-92-1.mol

Synonyms:140681-92-1;(2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic Acid;3-Pyridinepropanoicacid,-alpha--amino-1,6-dihydro-6-oxo-,(-alpha-S)-(9CI);3-aza-l-tyrosine;SCHEMBL229044;SCHEMBL10683581;AT32096;EN300-6766350;(2S)-2-amino-3-(6-hydroxypyridin-3-yl)propanoic acid;(2S)-2-AMINO-3-(6-OXO-1,6-DIHYDROPYRIDIN-3-YL)PROPANOIC ACID

Suppliers and Price of (2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)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
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Total 1 raw suppliers

Chemical Property of (2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic Acid

Chemical Property:

PSA：96.18000
LogP:0.02960
XLogP3:-3.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:182.06914219
Heavy Atom Count:13
Complexity:294

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=O)NC=C1CC(C(=O)O)N
Isomeric SMILES:C1=CC(=O)NC=C1C[C@@H](C(=O)O)N

Technology Process of (2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic Acid

There total 16 articles about (2S)-2-amino-3-(6-oxo-1H-pyridin-3-yl)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: 81.0%

: 169555-93-5,31140-74-6
(S)-β-(2-fluoro-5-pyridyl)alanine

: 140681-92-1
3-aza-L-tyrosine

Guidance literature:: With hydrogenchloride; for 8h; Heating;

Reference yield: 10.0%

: 109-00-2
3-HYDROXYPYRIDINE

: 127-17-3
2-oxo-propionic acid

: 140681-92-1
3-aza-L-tyrosine

Guidance literature:: With tyrosine phenol-lyase from Citrobacter freundii; pyridoxal 5'-phosphate; ammonium chloride; at 37 ℃; for 120h; pH=8.8 - 9.0;
DOI:10.1016/S0960-894X(01)00376-6

Reference yield:

: 26218-80-4
6-methoxy-nicotinic acid methyl ester

: 140681-92-1
3-aza-L-tyrosine

Guidance literature:: Multi-step reaction with 6 steps

1: 83 percent / DIBAH / CH₂Cl₂; hexane / 0.17 h / -20 °C

2: 99 percent / MnO₂ / CHCl₃ / 0.08 h / Ambient temperature

3: 1. t-BuOK / 1. CH₂Cl₂, -20 deg C, 5 min, 2. CH₂Cl₂, a.) -20 deg C, 2 h; b.) 0 deg C, 2 h

4: 96 percent / NaBH₄, NiCl₂-6H₂O / methanol / 0.08 h / Ambient temperature

5: 91 percent / TMSI / CHCl₃ / 0.67 h / Heating

6: KOH / methanol / Ambient temperature

With manganese(IV) oxide; potassium hydroxide; sodium tetrahydroborate; trimethylsilyl iodide; potassium tert-butylate; diisobutylaluminium hydride; nickel dichloride; In methanol; hexane; dichloromethane; chloroform;
DOI:10.1016/S0040-4020(01)92234-3