Demethylaaptamine

Base Information

Chemical Name:Demethylaaptamine
CAS No.:342882-90-0
Molecular Formula:C₁₁H₈N₂O₂
Molecular Weight:200.197
Hs Code.:
DSSTox Substance ID:DTXSID90434875
Nikkaji Number:J1.474.816D
Wikidata:Q82249450,Q105378967
ChEMBL ID:CHEMBL491094
Mol file:342882-90-0.mol

Synonyms:demethylaaptamine;8,9-di-O-aaptamine;8,9-Bisdemethyl aaptamine;CHEMBL491094;SCHEMBL8014478;DTXSID90434875;BDBM50476978;1H-Benzo[de][1,6]naphthyridine-8,9-diol (8,9-demethylaaptamine)

Suppliers and Price of Demethylaaptamine

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 Demethylaaptamine

Chemical Property:

PSA：68.88000
LogP:1.71500
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:200.058577502
Heavy Atom Count:15
Complexity:519

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CNC2=C3C1=CC(=O)C(=C3NC=C2)O

Technology Process of Demethylaaptamine

There total 4 articles about Demethylaaptamine 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:

: 120-20-7
2-(3,4-dimethoxyphenyl)-ethylamine

: 342882-90-0
8,9-dihydroxy-1H-benzo[d,e][1,6]naphthyridine

Guidance literature:: Multi-step reaction with 4 steps

1: 63 percent / N-ethylmorpholine; HOBt; DCC / tetrahydrofuran / 0 - 20 °C

2: 94 percent / POCl₃ / acetonitrile / 20 °C / Heating

3: 70 percent / aq. HBr / Heating

4: aq. KOH; K₂S₂O₈ / 2 h

With N-ethylmorpholine;; potassium hydroxide; dipotassium peroxodisulfate; hydrogen bromide; benzotriazol-1-ol; dicyclohexyl-carbodiimide; trichlorophosphate; In tetrahydrofuran; acetonitrile; 2: Bischler-Napieralski cyclization;
DOI:10.1016/S0040-4020(01)00101-6

Reference yield:

: 342428-63-1
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(trifluoroacetylamino)propanamide

: 342882-90-0
8,9-dihydroxy-1H-benzo[d,e][1,6]naphthyridine

Guidance literature:: Multi-step reaction with 3 steps

1: 94 percent / POCl₃ / acetonitrile / 20 °C / Heating

2: 70 percent / aq. HBr / Heating

3: aq. KOH; K₂S₂O₈ / 2 h

With potassium hydroxide; dipotassium peroxodisulfate; hydrogen bromide; trichlorophosphate; In acetonitrile; 1: Bischler-Napieralski cyclization;
DOI:10.1016/S0040-4020(01)00101-6

Reference yield:

: 342428-64-2
6,7-dimethoxy-1-[2-(trifluoroacetylamino)ethyl]-3,4-dihydroisoquinoline

: 342882-90-0
8,9-dihydroxy-1H-benzo[d,e][1,6]naphthyridine

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / aq. HBr / Heating

2: aq. KOH; K₂S₂O₈ / 2 h

With potassium hydroxide; dipotassium peroxodisulfate; hydrogen bromide;
DOI:10.1016/S0040-4020(01)00101-6