N(6)-(2-Carboxyethyl)adenine

Base Information

Chemical Name:N(6)-(2-Carboxyethyl)adenine
CAS No.:73094-99-2
Molecular Formula:C₈H₉N₅O₂
Molecular Weight:207.192
Hs Code.:2933990090
NSC Number:37388
UNII:PG9A8I4S8I
DSSTox Substance ID:DTXSID30223361
Wikidata:Q83101806
ChEMBL ID:CHEMBL278374
Mol file:73094-99-2.mol

Synonyms:N(6)-(2-carboxyethyl)adenine

Suppliers and Price of N(6)-(2-Carboxyethyl)adenine

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

Matrix Scientific
3-(9H-Purin-6-ylamino)-propionic acid
1g
$ 495.00

Crysdot
3-((9H-Purin-6-yl)amino)propanoicacid 97%
5g
$ 874.00

Chemenu
3-((9H-Purin-6-yl)amino)propanoicacid 97%
5g
$ 825.00

Total 7 raw suppliers

Chemical Property of N(6)-(2-Carboxyethyl)adenine

Chemical Property:

Vapor Pressure:2.67E-08mmHg at 25°C
Boiling Point:421.9°C at 760 mmHg
Flash Point:209°C
PSA：103.79000
Density:1.69g/cm³
LogP:0.31250
XLogP3:0.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:207.07562455
Heavy Atom Count:15
Complexity:237

Purity/Quality:

98%min ^*data from raw suppliers

3-(9H-Purin-6-ylamino)-propionic acid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=NC2=C(N1)C(=NC=N2)NCCC(=O)O

Technology Process of N(6)-(2-Carboxyethyl)adenine

There total 5 articles about N(6)-(2-Carboxyethyl)adenine 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%

: N-(9H-purin-6-yl)-β-alanine ethyl ester

: 73094-99-2
N-Purinyl-(6)-β-alanin

Guidance literature:: With sodium hydroxide; In ethanol; Heating;
DOI:10.1021/jm000095f

Reference yield: 60.0%

: 87-42-3
6-chloropurine

: 107-95-9
3-amino propanoic acid

: 73094-99-2
N⁶-β-alanyladenine

Guidance literature:: With sodium carbonate; In water; for 3.5h; Reflux;
DOI:10.1039/c9nj02279a

Reference yield:

: 73-24-5,71660-29-2,71660-30-5
7H-purin-6-ylamine

: 73094-99-2
N-Purinyl-(6)-β-alanin

Guidance literature:: Multi-step reaction with 2 steps

1: 98 percent / Triton-B / dimethylformamide / 0.5 h / 110 °C

2: 86 percent / aq.NaOH / ethanol / Heating

With sodium hydroxide; N-benzyl-trimethylammonium hydroxide; In ethanol; N,N-dimethyl-formamide;
DOI:10.1021/jm000095f