3-(Ethylamino)pyrrolidine

Base Information

• Chemical Name: 3-(Ethylamino)pyrrolidine
• CAS No.: 111390-22-8
• Molecular Formula: C6H14N2
• Molecular Weight: 114.191
• Hs Code.: 2933990090
• European Community (EC) Number: 679-979-7
• DSSTox Substance ID: DTXSID20558417
• Nikkaji Number: J382.998G
• Mol file: 111390-22-8.mol

Synonyms:3-(Ethylamino)pyrrolidine;111390-22-8;N-ethylpyrrolidin-3-amine;Ethyl-pyrrolidin-3-yl-amine;3-ethylaminopyrrolidine;3-ethylamino-pyrolidine;SCHEMBL2012943;DTXSID20558417;MFCD00191357;AKOS009159225;AM90658;SB45623;SB47860;CS-0440975;E0431;EN300-862152;T71595

Chemical Property of 3-(Ethylamino)pyrrolidine

Chemical Property:

• Refractive Index: 1.4710-1.4740
• Boiling Point: 167.665 °C at 760 mmHg
• PKA: 10.59±0.10(Predicted)
• Flash Point: 53.578 °C
• PSA: 24.06000
• Density: 0.912 g/cm³
• LogP: 0.67750
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 114.115698455
• Heavy Atom Count: 8
• Complexity: 63.5

Purity/Quality:

98% ^*data from raw suppliers

3-(Ethylamino)pyrrolidine ^*data from reagent suppliers

Safty Information:

• Statements: 10-34
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNC1CCNC1

Technology Process of 3-(Ethylamino)pyrrolidine

There total 1 articles about 3-(Ethylamino)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:

1-Benzyl-3-aminopyrrolidine (18471-40-4,60652-45-1,114715-38-7,114715-39-8) → 3-(ethylamino)pyrrolidine (111390-22-8,381670-31-1)

Guidance literature:

With sodium hydroxide; acetic anhydride; palladium on charcoal; In tetrahydrofuran; methanol; dichloromethane; water; acetic acid;

Reference yield: 98.0%

3-(ethylamino)pyrrolidine (111390-22-8,381670-31-1) + benzoyl chloride (98-88-4) → (+/-)-(3-(ethylamino)pyrrolidin-1-yl)(phenyl)methanone (1307683-65-3)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 24h; Inert atmosphere;

Reference yield: 66.0%

3-(ethylamino)pyrrolidine (111390-22-8,381670-31-1) + 3,4-Dichlorophenylmethyl chloride (102-47-6) → (+/-)-1-(3,4-dichlorobenzyl)-N-ethylpyrrolidin-3-amine (1307683-60-8)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 24h; Inert atmosphere;

upstream raw materials:

1-Benzyl-3-aminopyrrolidine

Downstream raw materials:

4-[3-(ethylamino)pyrrolidin-1-yl]-N-(4-fluorophenyl)-6-propylpyrimidin-2-amine

C₂₁H₂₁F₄N₃O₂

(+/-)-(3-(ethylamino)pyrrolidin-1-yl)(phenyl)methanone

(+/-)-1-(3,4-dichlorobenzyl)-N-ethylpyrrolidin-3-amine

Refernces

• 1、 -. "Antibacterial agents". . . Retrieved 2008/06/13.