Methyl 2-(4-aminocyclohexyl)acetate

Base Information

Chemical Name:Methyl 2-(4-aminocyclohexyl)acetate
CAS No.:76308-27-5
Molecular Formula:C9H17NO2
Molecular Weight:171.23678
Hs Code.:
DSSTox Substance ID:DTXSID10400577,DTXSID801284930

Synonyms:Methyl 2-(4-aminocyclohexyl)acetate;313683-56-6;(4-AMINO-CYCLOHEXYL)-ACETIC ACID METHYL ESTER;Methyl 2-((1s,4s)-4-aminocyclohexyl)acetate;76308-14-0;76308-27-5;methyl 2-[(1s,4s)-4-aminocyclohexyl]acetate;SCHEMBL1188558;SCHEMBL2742452;SCHEMBL13240738;SCHEMBL13240741;DTXSID10400577;DTXSID801284930;Methyl trans-4-aminocyclohexaneacetate;BB 0261456;methyl 2-[(1r,4r)-4-aminocyclohexyl]acetate;EN300-4769791;EN300-5228820;EN300-7837847

Suppliers and Price of Methyl 2-(4-aminocyclohexyl)acetate

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
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price

Total 1 raw suppliers

Chemical Property of Methyl 2-(4-aminocyclohexyl)acetate

Chemical Property:

PSA：52.32000
LogP:1.76730
XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:171.125928785
Heavy Atom Count:12
Complexity:151

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)CC1CCC(CC1)N

Technology Process of Methyl 2-(4-aminocyclohexyl)acetate

There total 1 articles about Methyl 2-(4-aminocyclohexyl)acetate 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:

: 67-56-1
methanol

: 61502-37-2
trans-(4-amino)-cyclohexylacetic acid hydrogen sulfate

: 76308-27-5
trans-4-aminocyclohexylacetic acid methyl ester

Guidance literature:: With sulfuric acid; for 5h; Heating;
DOI:10.1021/jm000090i

Reference yield:

: 24424-99-5
di-tert-butyl dicarbonate

: 76308-27-5
trans-4-aminocyclohexylacetic acid methyl ester

: 215789-45-0
trans-2-(1-(4-(N-tert-butoxycarbonyl)amino)cyclohexyl)acetic acid methyl ester

Guidance literature:: With triethylamine; In dichloromethane; at 20 ℃; for 18h;
DOI:10.1021/jm000090i

Reference yield:

: 76308-27-5
trans-4-aminocyclohexylacetic acid methyl ester

: 215790-43-5
trans-2-(2-(1-4-(N-tert-butyloxycarbonyl)amino)cyclohexyl)ethyl-7-cyano-1,2,3,4-tetrahydroisoquinoline

Guidance literature:: Multi-step reaction with 3 steps

1: Et₃N / CH₂Cl₂ / 18 h / 20 °C

2: diisobutylaluminum hydride / toluene / 0.3 h / -78 °C

3: NaBH(OAc)3 / 1,2-dichloro-ethane / 16 h / 20 °C

With sodium tris(acetoxy)borohydride; diisobutylaluminium hydride; triethylamine; In dichloromethane; 1,2-dichloro-ethane; toluene; 1: Acylation / 2: Reduction / 3: reductive amination;
DOI:10.1021/jm000090i