2-Chloro-1-piperidin-1-yl-ethanone

Base Information

• Chemical Name: 2-Chloro-1-piperidin-1-yl-ethanone
• CAS No.: 1440-60-4
• Molecular Formula: C7H12ClNO
• Molecular Weight: 161.631
• Hs Code.: 29333990
• NSC Number: 8198
• DSSTox Substance ID: DTXSID60278546
• Nikkaji Number: J246.862J
• Wikidata: Q82010501
• Mol file: 1440-60-4.mol

Synonyms:1440-60-4;2-Chloro-1-piperidin-1-yl-ethanone;2-chloro-1-(piperidin-1-yl)ethanone;1-(Chloroacetyl)piperidine;2-chloro-1-piperidin-1-ylethanone;Piperidine, 1-(chloroacetyl)-;2-chloro-1-(piperidin-1-yl)ethan-1-one;MFCD01095825;2-chloro-1-(1-piperidinyl)ethanone;NSC8198;N-chloroacetylpiperidine;N-chloroacetyl-piperidine;Pipridine, 1-chloroacetyl-;SCHEMBL48352;1-(2-chloroacetyl)piperidine;1-(Chloroacetyl)piperidine #;N-(alpha-chloroacetyl)piperidine;N-(2-Chloro-acetyl)-piperidine;DTXSID60278546;Piperidine, N-[2-chloroacetyl]-;NSC 8198;NSC-8198;2-chloro-1-piperidin-1-ylmethanone;PDSP1_001475;PDSP2_001459;STK398093;2-Chloro-1-piperidine-1-yl-ethanone;1-(piperidin-1-yl)-2-chloroethanone;AKOS000322075;2-chloranyl-1-piperidin-1-yl-ethanone;CS-W021632;GS-6016;SB41339;Ethanone, 2-chloro-1-(1-piperidinyl)-;SY064187;BB 0217798;FT-0658134;EN300-01775;H10613;A808164;AT-057/40388402;Z56891386;Boc-(R)-3-Amino-3-(2,3-dichloro-phenyl)-propionicacid;F2190-0189

Chemical Property of 2-Chloro-1-piperidin-1-yl-ethanone

Chemical Property:

• Appearance/Colour: clear pale yellow liquid
• Vapor Pressure: 0.00689mmHg at 25°C
• Refractive Index: 1.492
• Boiling Point: 270.3 °C at 760 mmHg
• Flash Point: 117.3 °C
• PSA: 20.31000
• Density: 1.153 g/cm³
• LogP: 1.17560
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 161.0607417
• Heavy Atom Count: 10
• Complexity: 121

Purity/Quality:

99% ^*data from raw suppliers

2-Chloro-1-piperidin-1-yl-ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C(=O)CCl

Technology Process of 2-Chloro-1-piperidin-1-yl-ethanone

There total 6 articles about 2-Chloro-1-piperidin-1-yl-ethanone 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%

piperidine (110-89-4) + chloroacetyl chloride (79-04-9) → 1-chloroacetyl-piperidine (1440-60-4)

Guidance literature:

In acetone; at 20 ℃;

DOI:10.1139/v04-028

Reference yield: 92.0%

piperidine (110-89-4) → 1-chloroacetyl-piperidine (1440-60-4) + lactanilide (106942-22-7,125473-43-0,6252-10-4)

Guidance literature:

Reference yield: 44.0%

1-(2-bromoacetyl)piperidine (1796-25-4) → 1-chloroacetyl-piperidine (1440-60-4)

Guidance literature:

With S₄N₄*SbCl₅; In toluene; Heating;

DOI:10.1016/S0040-4039(97)00850-2

upstream raw materials:

piperidine

chloroacetyl chloride

chloroacetic acid

1-(2-bromoacetyl)piperidine

Downstream raw materials:

1-[N-(2,3-dihydro-benzo[1,4]dioxin-2-ylmethyl)-glycyl]-piperidine

1-cyanoacetylpiperidine

(4-nitro-benzyl)-(2-oxo-2-piperidino-ethyl)-dipropyl-ammonium; bromide

1-(N-phenyl-glycyl)-piperidine

Refernces

• 1、 Sharma, Pankaj,Reddy, T. Srinivasa,Kumar, Niggula Praveen,Senwar, Kishna Ram,Bhargava, Suresh K.,Shankaraiah, Nagula. "Conventional and microwave-assisted synthesis of new 1H-benzimidazole-thiazolidinedione derivatives: A potential anticancer scaffold". . p. 234 - 245. Retrieved 2017.
• 2、 Meshcheryakova. "Synthesis of 3-(aminooxoethyl)-6-methyl-1-(thiethan-3-yl)-pyrimidine-2,4-(1H,3H)-diones". . p. 1539 - 1542. Retrieved 2014.
• 3、 Shi, Xingpeng,Quan, Yanni,Wang, Yixuan,Wang, Ying,Li, Yanping. "Design, synthesis, and biological evaluation of 2,6,7-substituted pyrrolo[2,3-d]pyrimidines as cyclin dependent kinase inhibitor in pancreatic cancer cells". . . Retrieved 2021.
• 4、 Deshmukh, Tejshri R.,Khare, Smita P.,Krishna, Vagolu S.,Sriram, Dharmarajan,Sangshetti, Jaiprakash N.,Bhusnure, Omprakash,Khedkar, Vijay M.,Shingate, Bapurao B.. "Design and Synthesis of New Aryloxy-linked Dimeric 1,2,3-Triazoles via Click Chemistry Approach: Biological Evaluation and Molecular Docking Study". . p. 2144 - 2162. Retrieved 2019.
• 5、 Lasalle, Manuel,Picon, Sylvain,Boulahjar, Rajaa,Hoguet, Vanessa,Van Obbergen, Jolien,Roussel, Pascal,Deprez, Benoit,Charton, Julie. "Access to newly functionalized imidazole derivatives: Efficient synthesis of novel 5-amino-2-thioimidazoles using propylphosphonic anhydride (T3P)". . p. 1011 - 1014. Retrieved 2015.
• 6、 Alotaibi, Faez,Halaweish, Fathi,Halaweish, Hossam,Iram, Surtaj,Kasten, Abigail,Kyeremateng, Jennifer,Ostlund, Trevor. "Triazole-estradiol analogs: A potential cancer therapeutic targeting ovarian and colorectal cancer". . . Retrieved 2021/12/27.
• 7、 Abdulghani, Saba S.,Alsamarrai, Abdulmajeed S. H.. "Microwave-assisted synthesis, structural characterization and assessment of the antibacterial activity of some new aminopyridine, pyrrolidine, piperidine and morpholine acetamides". . . Retrieved 2021/06/14.