1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R,R)]-

Base Information

Chemical Name:1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]-
CAS No.:177948-66-2
Molecular Formula:C₁₈H₂₈N₂O₂
Molecular Weight:304.433
Hs Code.:
DSSTox Substance ID:DTXSID201112680

Synonyms:DTXSID201112680;1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]-;177948-66-2

Suppliers and Price of 1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]-

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 0 raw suppliers

Chemical Property of 1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]-

Chemical Property:

XLogP3:3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:304.215078140
Heavy Atom Count:22
Complexity:359

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C1=CC=CC=C1)NCC2CCN(C2)C(=O)OC(C)(C)C
Isomeric SMILES:C[C@@H](C1=CC=CC=C1)NC[C@@H]2CCN(C2)C(=O)OC(C)(C)C

Technology Process of 1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]-

There total 4 articles about 1-Pyrrolidinecarboxylic acid, 3-[[(1-phenylethyl)amino]methyl]-, 1,1-dimethylethyl ester, [S-(R*,R*)]- 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:

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

: 177948-66-2
(3S)-N-tert-butyloxycarbonyl-3-(N-[S]-alpha-methylbenzyl)aminomethylpyrrolidine

Guidance literature:: Multi-step reaction with 3 steps

1: 100 percent / H₂ / Pearlmans catalyst / methanol; H₂O / 2 h / 2068.59 Torr

2: 100 percent / Et₃N / CH₂Cl₂ / 16 h / Ambient temperature

3: toluene / 18 h / Heating

With hydrogen; triethylamine; palladium hydroxide - carbon; In methanol; dichloromethane; water; toluene;
DOI:10.1021/jm9805687

Reference yield:

: 99735-47-4
(3R)-1-[(R)-1-phenylethyl]-3-(hydroxymethyl)pyrrolidine

: 177948-66-2
(3S)-N-tert-butyloxycarbonyl-3-(N-[S]-alpha-methylbenzyl)aminomethylpyrrolidine

Guidance literature:: Multi-step reaction with 3 steps

1: 100 percent / H₂ / Pearlmans catalyst / methanol; H₂O / 2 h / 2068.59 Torr

2: 100 percent / Et₃N / CH₂Cl₂ / 16 h / Ambient temperature

3: toluene / 18 h / Heating

With hydrogen; triethylamine; palladium hydroxide - carbon; In methanol; dichloromethane; water; toluene;
DOI:10.1021/jm9805687

Reference yield:

: 138108-72-2
tert-butyl (R)-3-hydroxymethylpyrrolidine-1-carboxylate

: 177948-66-2
(3S)-N-tert-butyloxycarbonyl-3-(N-[S]-alpha-methylbenzyl)aminomethylpyrrolidine

Guidance literature:: Multi-step reaction with 2 steps

1: 100 percent / Et₃N / CH₂Cl₂ / 16 h / Ambient temperature

2: toluene / 18 h / Heating

With triethylamine; In dichloromethane; toluene;
DOI:10.1021/jm9805687