1-(Prop-2-yn-1-yl)pyrrolidine

Base Information

• Chemical Name: 1-(Prop-2-yn-1-yl)pyrrolidine
• CAS No.: 7223-42-9
• Molecular Formula: C7H11N
• Molecular Weight: 109.171
• Hs Code.: 2933990090
• European Community (EC) Number: 825-002-6
• NSC Number: 172884
• DSSTox Substance ID: DTXSID90305950
• Nikkaji Number: J554.326F
• Wikidata: Q82052783
• Mol file: 7223-42-9.mol

Synonyms:1-(prop-2-yn-1-yl)pyrrolidine;7223-42-9;1-(PROP-2-YNYL)PYRROLIDINE;1-prop-2-ynylpyrrolidine;1-Prop-2-yn-1-ylpyrrolidine;MFCD03727329;1-(2-Propynyl)pyrrolidine;1-(2-Propyn-1-yl)pyrrolidine;NSC172884;N-Propargylpyrrolidine;1-Propargylpyrrolidine;3-pyrrolidinoprop-1-yne;N-(2-Propynyl)pyrrolidine;1-prop-2-ynyl-pyrrolidine;SCHEMBL123292;1-(2-Propynyl)pyrrolidine #;DTXSID90305950;1-(pyrrolidin-1-yl)-prop-2-yne;AMY20751;AKOS009027608;AB15844;NSC 172884;NSC-172884;BS-12913;SY102558;CS-0058395;EN300-67613;W15840;A837457

Chemical Property of 1-(Prop-2-yn-1-yl)pyrrolidine

Chemical Property:

• Vapor Pressure: 7.74mmHg at 25°C
• Refractive Index: 1.486
• Boiling Point: 135.4 °C at 760 mmHg
• Flash Point: 27.6 °C
• PSA: 3.24000
• Density: 0.928 g/cm³
• LogP: 0.65330
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 109.089149355
• Heavy Atom Count: 8
• Complexity: 103

Purity/Quality:

98%min ^*data from raw suppliers

1-prop-2-yn-1-ylpyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CCN1CCCC1

Technology Process of 1-(Prop-2-yn-1-yl)pyrrolidine

There total 5 articles about 1-(Prop-2-yn-1-yl)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-(4-Methoxy-phenyl)-1-phenyl-4-pyrrolidin-1-yl-but-2-yn-1-ol (154554-70-8) → 1-(prop-2-yn-1-yl)pyrrolidine (7223-42-9) + 4-Methoxybenzophenone (611-94-9)

Guidance literature:

With potassium hydroxide; In methanol; water; for 26h; Heating;

Reference yield:

Butinolin-dihydrogenphosphate (57248-89-2) → 1-(prop-2-yn-1-yl)pyrrolidine (7223-42-9) + benzophenone (119-61-9)

Guidance literature:

With potassium hydroxide; In methanol; water; for 144h; Heating;

Reference yield:

1,1-diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol (968-63-8) → 1-(prop-2-yn-1-yl)pyrrolidine (7223-42-9) + benzophenone (119-61-9) + 1,1-diphenyl-2-butyn-1-ol (836-87-3)

Guidance literature:

at 750 - 1000 ℃; under 0.0008 Torr; Product distribution; also stability of the title compound in acidic and alkaline solutions; further substrates and products;

upstream raw materials:

1,1-diphenyl-4-(pyrrolidin-1-yl)but-2-yn-1-ol

1-Phenyl-4-pyrrolidin-1-yl-1-p-tolyl-but-2-yn-1-ol

1-(4-Methoxy-phenyl)-1-phenyl-4-pyrrolidin-1-yl-but-2-yn-1-ol

Butinolin-dihydrogenphosphate

Downstream raw materials:

1-(6-diethylamino-hex-2-ynyl)-pyrrolidine

1,6-dipyrrolidino-hex-2-yne

1-cyclohexyl-1-phenyl-4-pyrrolidino-but-2-yn-1-ol

(4-{3,3-bis-[4-(3-pyrrolidin-1-yl-prop-1-ynyl)phenyl]allyloxy}-2-methylphenoxy)acetic acid methyl ester

Refernces

• 1、 Unterhalt,Middelberg. "The stability of butinoline". . p. 492 - 494. Retrieved 2007/10/02.