2-Propyn-1-amine, N,N-diethyl-

Base Information

• Chemical Name: 2-Propyn-1-amine, N,N-diethyl-
• CAS No.: 125678-52-6
• Molecular Formula: C₇H₁₃N
• Molecular Weight: 111.187
• European Community (EC) Number: 223-804-5
• NSC Number: 63868
• UNII: 9X1BTC8Y1U
• DSSTox Substance ID: DTXSID5063287
• Nikkaji Number: J35.384A
• Wikidata: Q72469174
• Mol file: 125678-52-6.mol

Synonyms:4079-68-9;1-Diethylamino-2-propyne;N,N-Diethylpropargylamine;2-Propyn-1-amine, N,N-diethyl-;N,N-diethylprop-2-yn-1-amine;Diethylpropargylamine;3-Diethylamino-1-propyne;N,N-Diethyl-2-propynylamine;3-(Diethylamino)propyne;3-(N,N-Diethylamino)propyne;1-N,N-Diethylamino-2-propyne;2-PROPYNYLAMINE, N,N-DIETHYL-;Dietylaminopropin;NSC 63868;EINECS 223-804-5;diethyl-prop-2-ynyl-amine;BRN 1098468;9X1BTC8Y1U;NSC-63868;4-04-00-01136 (Beilstein Handbook Reference);NSC63868;2-Propyn-1-amine, N ,N -diethyl-;1-Diethylaminopropyne-2;N,N-diethyl propargylamine;UNII-9X1BTC8Y1U;2-Propynylamine,N-diethyl-;NCIOpen2_000253;SCHEMBL169244;2-Propyn-1-amine,N-diethyl-;diethyl(prop-2-yn-1-yl)amine;DTXSID5063287;WLN: 2N2&2UU1;N, N-diethylprop-2-yn-1-amine;N,N-diethyl-N-(2-propynyl)amine;N,N-Diethyl-2-propyn-1-amine #;MFCD00039881;AKOS009027472;AS-31060;LS-125798;D5393;FT-0613816;EN300-108688;N,N-Diethylpropargylamine, for protein sequence analysis, >=99.0% (GC)

Chemical Property of 2-Propyn-1-amine, N,N-diethyl-

Chemical Property:

• Refractive Index: 1.4190-1.4320
• PSA: 40.54000
• Density: 1.04 g/cm³
• LogP: 1.29810
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 111.104799419
• Heavy Atom Count: 8
• Complexity: 83.8

Purity/Quality:

99% ^*data from raw suppliers

DIETHYLAMINOPROPYNE FORMATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC#C
• Uses: Diethylaminopropyne formate(PABS) can be used as an intermediate of electroplating additive to prepare nickel plating brightening agent.

Technology Process of 2-Propyn-1-amine, N,N-diethyl-

There total 15 articles about 2-Propyn-1-amine, N,N-diethyl- 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: 94.0%

diethylamine (109-89-7) + propargyl bromide (106-96-7) → N,N-diethyl-2-propynylamine (4079-68-9,125678-52-6)

Guidance literature:

With potassium carbonate; In toluene; at 20 ℃; for 15h;

Reference yield: 80.0%

2-propynyl chloride (624-65-7) + diethylamine (109-89-7) → N,N-diethyl-2-propynylamine (4079-68-9,125678-52-6)

Guidance literature:

With sodium carbonate;

DOI:10.1016/0040-4020(82)87013-0

Reference yield: 47.0%

→ N,N-diethyl-2-propynylamine (4079-68-9,125678-52-6)

Guidance literature:

upstream raw materials:

diethyl-(2-bromo-allyl)-amine

6-diethylamino-3-methyl-hex-4-yn-3-ol

sodium methylate

2-propynyl chloride

Downstream raw materials:

N,N-diethylhept-2-yn-1-amine

diethyl-hex-2-ynyl-amine

but-2-ynyldiethylamine

(C₆H₅)2SbCCCH₂N(C₂H₅)2

Refernces

• 1、 Sauer et al.. "-". . p. 693,695. Retrieved 1959.
• 2、 Settypalli, Triloknadh,Chunduri, Venkata Rao,Maddineni, Aruna Kumari,Begari, Nagaraju,Allagadda, Rajasekhar,Kotha, Peddanna,Chippada, Appa Rao. "Design, synthesis,: In silico docking studies and biological evaluation of novel quinoxaline-hydrazide hydrazone-1,2,3-triazole hybrids as α-glucosidase inhibitors and antioxidants". . p. 15435 - 15452. Retrieved 2019.
• 3、 -. "Pleuromutilin derivative with triazole side chain, and preparation method and application thereof". Paragraph 0137-0139. . Retrieved 2020/03/02.
• 4、 Zhang, Guang-Yu,Zhang, Zhe,Li, Kang,Liu, Jie,Li, Bo,Jin, Zhen,Liu, Ya-Hong,Tang, You-Zhi. "Design, synthesis and biological evaluation of novel pleuromutilin derivatives containing piperazine and 1,2,3-triazole linker". . . Retrieved 2020/11/02.