(S)-1-Boc-2-(2-hydroxyethyl)pyrrolidine

Base Information

• Chemical Name: (S)-1-Boc-2-(2-hydroxyethyl)pyrrolidine
• CAS No.: 88790-38-9
• Molecular Formula: C11H21NO3
• Molecular Weight: 215.293
• European Community (EC) Number: 962-153-8
• Nikkaji Number: J1.177.526H
• Mol file: 88790-38-9.mol

Synonyms:88790-38-9;(S)-1-BOC-2-(2-HYDROXYETHYL)PYRROLIDINE;tert-butyl (2S)-2-(2-hydroxyethyl)pyrrolidine-1-carboxylate;(S)-tert-Butyl 2-(2-hydroxyethyl)pyrrolidine-1-carboxylate;MFCD21642025;SCHEMBL115698;1-BOC-2-(S)-pyrrolidineethanol;MXPOLUPSEVGAAS-VIFPVBQESA-N;AKOS025291158;AS-34302;N-tert-butoxycarbonyl-L-beta-homoprolinol;CS-0048623;EN300-1178692;A861454;(S)-tert-butyl-2-(2-hydroxyethyl)pyrrolidine-1-carboxylate;(S)-tert-Butyl2-(2-hydroxyethyl)pyrrolidine-1-carboxylate;1,1-dimethylethyl (2s)-2-(2-hydroxyethyl)-1-pyrrolidinecarboxylate

Chemical Property of (S)-1-Boc-2-(2-hydroxyethyl)pyrrolidine

Chemical Property:

• Boiling Point: 306.0±15.0 °C(Predicted)
• PKA: 15.03±0.10(Predicted)
• PSA: 49.77000
• Density: 1.065±0.06 g/cm3(Predicted)
• LogP: 1.70620
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 215.15214353
• Heavy Atom Count: 15
• Complexity: 222

Purity/Quality:

97% ^*data from raw suppliers

tert-Butyl (2S)-2-(2-hydroxyethyl)pyrrolidine-1-carboxylate 97.0% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)N1CCCC1CCO
• Isomeric SMILES: CC(C)(C)OC(=O)N1CCC[C@H]1CCO

Technology Process of (S)-1-Boc-2-(2-hydroxyethyl)pyrrolidine

There total 17 articles about (S)-1-Boc-2-(2-hydroxyethyl)pyrrolidine 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: 100.0%

(2S)-1-tert-butoxycarbonyl-2-carboxymethylpyrrolidine (56502-01-3) → (2S)-tert-butyl 2-(2-hydroxyethyl)pyrrolidine-1-carboxylate (88790-38-9,220312-34-5)

Guidance literature:

With borane-THF; In tetrahydrofuran; at 20 ℃; for 17h;

Reference yield: 98.5%

(2S)-tert-Butyl 2-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylate (88790-37-8,132482-05-4,813433-68-0) → (2S)-tert-butyl 2-(2-hydroxyethyl)pyrrolidine-1-carboxylate (88790-38-9,220312-34-5)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 - 20 ℃; for 3h;

Reference yield: 87.0%

tert-butyl (S)-2-vinylpyrrolidine-1-carboxylate (115393-77-6) → (2S)-tert-butyl 2-(2-hydroxyethyl)pyrrolidine-1-carboxylate (88790-38-9,220312-34-5)

Guidance literature:

tert-butyl (S)-2-vinylpyrrolidine-1-carboxylate; With dimethylsulfide borane complex; In tetrahydrofuran; at 0 - 20 ℃; Inert atmosphere;

With dihydrogen peroxide; sodium hydroxide; In tetrahydrofuran; water; at 0 - 20 ℃;

DOI:10.1016/j.tetasy.2011.08.011

upstream raw materials:

(2S)-tert-Butyl 2-(2-methoxy-2-oxoethyl)pyrrolidine-2-carboxylate

(2S)-1-tert-butoxycarbonyl-2-carboxymethylpyrrolidine

oxirane

tert-butyl pyrrolidine-1-carboxylate

Downstream raw materials:

methyl 2-({[2-({2-[(2S)-(N-tert-butoxycarbonyl)pyrrolidin-2-yl]ethyl}amino)phenyl]sulfonyl}amino)-5,6,7,8-tetrahydro-1-naphthalenecarboxylate

methyl 2-({[2-({2-[(2S)-2-pyrrolidinyl]ethyl}amino)phenyl]sulfonyl}amino)-5,6,7,8-tetrahydro-1-naphthalenecarboxylate

3-R-7-S-1-aza-3-benzyl-3-methyl-4-thiabicyclo[5.3.0]-2-decanone

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