2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one

Base Information

Chemical Name:2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one
CAS No.:183593-62-6
Molecular Formula:C15H25NO2
Molecular Weight:251.369
Hs Code.:
DSSTox Substance ID:DTXSID60571120

Synonyms:183593-62-6;2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one;DTXSID60571120

Suppliers and Price of 2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one

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 4 raw suppliers

Chemical Property of 2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one

Chemical Property:

XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:251.188529040
Heavy Atom Count:18
Complexity:308

Purity/Quality:: 99.90% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=CC1(CCCCC1)CC(=O)N2CCCC2CO
Isomeric SMILES:C=CC1(CCCCC1)CC(=O)N2CCC[C@H]2CO

Technology Process of 2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one

There total 3 articles about 2-(1-Ethenylcyclohexyl)-1-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one 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:

: 1552-92-7
ethyl cyclohexylideneacetate

: 183593-62-6
1-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-2-(1-vinyl-cyclohexyl)-ethanone

Guidance literature:: Multi-step reaction with 3 steps

1: LiAlH₄ / diethyl ether

2: 1.) CH₃CH₂CO₂H, 2.) KOH / 1.) reflux, 2.) MeOH, reflux, 5 h

3: 1.) HOBt, 2.) 1-<3-(dimethylamino)propyl>-3-ethylcarbodiimide / 1.) CH₂Cl₂, 0 deg C, 5 min, 2.) CH₂Cl₂, RT, overnight

With potassium hydroxide; lithium aluminium tetrahydride; benzotriazol-1-ol; propionic acid; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; In diethyl ether;
DOI:10.1021/ja961887v

Reference yield:

: 932-89-8
2-cyclohexylidene ethanol

: 183593-62-6
1-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-2-(1-vinyl-cyclohexyl)-ethanone

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) CH₃CH₂CO₂H, 2.) KOH / 1.) reflux, 2.) MeOH, reflux, 5 h

2: 1.) HOBt, 2.) 1-<3-(dimethylamino)propyl>-3-ethylcarbodiimide / 1.) CH₂Cl₂, 0 deg C, 5 min, 2.) CH₂Cl₂, RT, overnight

With potassium hydroxide; benzotriazol-1-ol; propionic acid; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide;
DOI:10.1021/ja961887v

Reference yield:

: 183593-61-5
(1'-ethenylcyclohex-1'-yl)acetic acid

: 23356-96-9
(S)-1-Pyrrolidin-2-yl-methanol

: 183593-62-6
1-((S)-2-Hydroxymethyl-pyrrolidin-1-yl)-2-(1-vinyl-cyclohexyl)-ethanone

Guidance literature:: With benzotriazol-1-ol; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; Yield given. Multistep reaction; 1.) CH₂Cl₂, 0 deg C, 5 min, 2.) CH₂Cl₂, RT, overnight;
DOI:10.1021/ja961887v