N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Base Information

Chemical Name:N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CAS No.:135729-78-1
Molecular Formula:C18H24N2O
Molecular Weight:284.40
Hs Code.:2933990090
DSSTox Substance ID:DTXSID90599736
Mol file:135729-78-1.mol

Synonyms:135729-78-1;N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide;(S)-N-(1-AZABICYCLO[2.2.2]OCT-3-YL)-5,6,7,8-TETRAHYDRO-1-NAPHTHALENECARBOXAMIDE;SCHEMBL1160143;DTXSID90599736;SB46610;N-(Quinuclidin-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Suppliers and Price of N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide

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
(S)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-5,6,7,8-tetrahydro-1-naphthalenecarboxamide
1g
$ 910.00

Medical Isotopes, Inc.
N-(3S)-1-Azabicyclo[2.2.2]oct-3-yl-5,6,7,8-tetrahydro-1-naphthalenecarboxamide
25 mg
$ 650.00

Medical Isotopes, Inc.
N-(3S)-1-Azabicyclo[2.2.2]oct-3-yl-5,6,7,8-tetrahydro-1-naphthalenecarboxamide
250 mg
$ 1250.00

Crysdot
(S)-N-(Quinuclidin-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide 95+%
1g
$ 683.00

Chemenu
(S)-N-(quinuclidin-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide 95%
1g
$ 645.00

American Custom Chemicals Corporation
5,6,7,8-TETRAHYDRO-NAPHTHALENE-1-CARBOXYLIC ACID (1-AZA-BICYCLO[2.2.2]OCT-3-YL)-AMIDE 95.00%
5MG
$ 504.97

Alichem
(S)-N-(Quinuclidin-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide
1g
$ 690.00

Total 34 raw suppliers

Chemical Property of N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Chemical Property:

Vapor Pressure:6.48E-08mmHg at 25°C
Refractive Index:1.609
Boiling Point:439.2 °C at 760 mmHg
Flash Point:219.4 °C
PSA：32.34000
Density:1.17 g/cm³
LogP:2.71820
Storage Temp.:Refrigerator
Solubility.:Chloroform (Slightly), Methanol (Slightly)
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:284.188863393
Heavy Atom Count:21
Complexity:389

Purity/Quality:

99% ^*data from raw suppliers

(S)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-5,6,7,8-tetrahydro-1-naphthalenecarboxamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC2=C(C1)C=CC=C2C(=O)NC3CN4CCC3CC4
Uses (S)-N-(1-Azabicyclo[2.2.2]oct-3-yl)-5,6,7,8-tetrahydro-1-naphthalenecarboxamide is an impurity in the synthesis of Palonosetron HCl (P165800), a serotonin 5-HT3 receptor antagonist used in the prevention and treatment of chemotherapy-induced nausea and vomiting (CINV). Antiemetic.

Technology Process of N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide

There total 5 articles about N-(1-azabicyclo[2.2.2]octan-3-yl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide 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: 96.0%

: 110808-69-0
5,6,7,8-tetrahydronaphthylene-1-carboxylic acid chloride

: 6530-09-2,119904-90-4,120538-52-5,123536-14-1,124577-62-4,126358-22-3,137661-30-4,137661-31-5
(S)-1-azabicyclo[2.2.2]oct-3-ylamine dihydrochloride

: 135729-78-1
N-<(S)-1-azabicyclo<2.2.2>oct-3-yl>-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Guidance literature:: (S)-1-azabicyclo[2.2.2]oct-3-ylamine dihydrochloride; With sodium hydroxide; water; In toluene; at 60 ℃; for 1h;

5,6,7,8-tetrahydronaphthylene-1-carboxylic acid chloride; In toluene; at 60 ℃; for 1.5h; Product distribution / selectivity;

Reference yield: 88.6%

: 110808-69-0
5,6,7,8-tetrahydronaphthylene-1-carboxylic acid chloride

: 120570-05-0,781591-76-2
(S)-3-aminoquinuclidine

: 135729-78-1
N-<(S)-1-azabicyclo<2.2.2>oct-3-yl>-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Guidance literature:: In toluene; at 40 - 65 ℃; Inert atmosphere;

Reference yield: 69.0%

: 4242-18-6
5,6,7,8-tetrahydro-1-naphthalenecarboxylic acid

: (S)-3-aminoquinuclidine dihydrochloride

: 135729-78-1
N-<(S)-1-azabicyclo<2.2.2>oct-3-yl>-5,6,7,8-tetrahydronaphthalene-1-carboxamide

Guidance literature:: With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 27h;
DOI:10.1021/acschemneuro.6b00192