Altinicline

Base Information

Chemical Name:Altinicline
CAS No.:179120-92-4
Molecular Formula:C₁₂H₁₄N₂
Molecular Weight:186.257
Hs Code.:
UNII:RJ9V9V09VM
DSSTox Substance ID:DTXSID40870143
Nikkaji Number:J763.592C
Wikipedia:Altinicline
Wikidata:Q4736710
NCI Thesaurus Code:C77841
ChEMBL ID:CHEMBL111659
Mol file:179120-92-4.mol

Synonyms:5-ethynyl-3-(1-methyl-2-pyrrolidinyl)pyridine maleate;altinicline maleate;SIB 1508Y;SIB-1508Y

Suppliers and Price of Altinicline

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

TRC
5-EthynylNicotine
10mg
$ 265.00

Medical Isotopes, Inc.
5-Ethynylnicotine
25 mg
$ 2120.00

American Custom Chemicals Corporation
5-ETHYNYL NICOTINE 95.00%
5MG
$ 774.40

Total 7 raw suppliers

Chemical Property of Altinicline

Chemical Property:

Vapor Pressure:0.00245mmHg at 25°C
Boiling Point:287.7°C at 760 mmHg
PKA:7.83±0.70(Predicted)
Flash Point:127.8°C
PSA：16.13000
Density:1.09±0.1 g/cm3(Predicted)
LogP:1.76750
Storage Temp.:-20°C Freezer
Solubility.:Chloroform (Slightly), Ethanol (Slightly), Methanol (Slightly)
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:186.115698455
Heavy Atom Count:14
Complexity:240

Purity/Quality:

96% ^*data from raw suppliers

5-EthynylNicotine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCCC1C2=CN=CC(=C2)C#C
Isomeric SMILES:CN1CCC[C@H]1C2=CN=CC(=C2)C#C
Uses An intermediate of nicotinic acetylcholine receptor agonist SIB-1508Y. Used for the treatment of neurological disorders 5-Ethynylnicotine is an intermediate of nicotinic acetylcholine receptor agonist SIB-1508Y. 5-Ethynylnicotine is used for the treatment of neurological disorders. SIB 1508Y is a neuronal nicotinic acetylcholine receptor agonist. In rat studies, SIB 1508Y increased dopamine release and showed antidepressant activity. SIB 1508Y is an anti-Parkinson''s agent.

Technology Process of Altinicline

There total 22 articles about Altinicline 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: 98.0%

: 916046-39-4
(S)-5-[(triisopropylsilyl)ethynyl]nicotine

: 179120-92-4
altinicline

Guidance literature:: With tetrabutyl ammonium fluoride; In tetrahydrofuran; at 20 ℃; for 0.333333h;
DOI:10.1021/jo0616052

Reference yield: 97.0%

: 179120-91-3
2-Methyl-4-[5-((S)-1-methyl-pyrrolidin-2-yl)-pyridin-3-yl]-but-3-yn-2-ol

: 179120-92-4
altinicline

Guidance literature:: With sodium hydride; In toluene;
DOI:10.1021/jm960328w

Reference yield: 51.0%

: 852238-97-2
(S)-nicotine-5-carboxaldehyde

: 179120-92-4
altinicline

Guidance literature:: dimethyl diazomethylphosphonate; With potassium tert-butylate; In tetrahydrofuran; at -78 ℃; for 0.0833333h;

(S)-nicotine-5-carboxaldehyde; In tetrahydrofuran; at -78 - 20 ℃; for 18h;