beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-

Base Information

Chemical Name:beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-
CAS No.:87168-41-0
Molecular Formula:C₁₃H₂₄N₂O₂*2ClH
Molecular Weight:313.268
Hs Code.:
DSSTox Substance ID:DTXSID101007375
Mol file:87168-41-0.mol

Synonyms:beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-;87168-40-9;endo-N,N-Dimethyl-beta-alanine 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester 2HCl hydrate;exo-N,N-Dimethyl-beta-alanine 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester dihydrochloride;87168-41-0;beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, hydrate, endo-;C13H24N2O2.2ClH;DTXSID101007375;C13H24N2O2.2ClH.H2O;C13-H24-N2-O2.2Cl-H;LS-16074;LS-16075;C13-H24-N2-O2.2Cl-H.H2-O;8-Methyl-8-azabicyclo[3.2.1]octan-3-yl N,N-dimethyl-beta-alaninate--hydrogen chloride (1/2)

Suppliers and Price of beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-

Chemical Property:

Vapor Pressure:0.000491mmHg at 25°C
Boiling Point:313.6°Cat760mmHg
Flash Point:143.5°C
PSA：32.78000
Density:g/cm³
LogP:2.64840
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:312.1371335
Heavy Atom Count:19
Complexity:267

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2CCC1CC(C2)OC(=O)CCN(C)C.Cl.Cl

Technology Process of beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo-

There total 4 articles about beta-Alanine, N,N-dimethyl-, 8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, dihydrochloride, exo- 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: 62.8%

: Tropinyl-β-chloropropionate hydrochloride

: 124-40-3
dimethyl amine

: 87168-40-9,87168-41-0
3-Dimethylamino-propionic acid (1R,3R,5S)-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester; hydrochloride

Guidance literature:: In ethanol; toluene; for 8h; Heating;
DOI:10.1007/BF00765640

Reference yield: 52.2%

: 3-Chloro-propionic acid (1R,3S,5S)-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester; hydrochloride

: 124-40-3
dimethyl amine

: 87168-40-9,87168-41-0
3-Dimethylamino-propionic acid (1R,3S,5S)-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester; hydrochloride

Guidance literature:: In ethanol; toluene; for 8h; Heating;
DOI:10.1007/BF00765640

Reference yield:

: 120-29-6
3-tropanol

: 87168-40-9,87168-41-0
3-Dimethylamino-propionic acid (1R,3R,5S)-8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl ester; hydrochloride

Guidance literature:: Multi-step reaction with 2 steps

1: 83 percent / toluene / 4 h / Heating

2: 62.8 percent / ethanol; toluene / 8 h / Heating

In ethanol; toluene;
DOI:10.1007/BF00765640