Cas no 713522-75-9 (Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]-)
![Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]- structure](https://ossimg.kuujia.com/scimg/714000/713522-75-9x500.png)
713522-75-9 structure
Product Name:Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]-
CAS No:713522-75-9
MF:C10H19ClN2O
MW:218.723661661148
CID:558077
PubChem ID:2757620
Update Time:2025-04-19
Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]-
- 2-chloro-1-[4-(2-methylpropyl)piperazin-1-yl]ethanone
- Piperazine, 1-(chloroacetyl)-4-(2-methylpropyl)- (9CI)
- 1-(CHLOROACETYL)-4-(2-METHYLPROPYL)-PIPERAZINE
- 2-CHLORO-1-(4-ISOBUTYL-PIPERAZIN-1-YL)-ETHANONE
- AC1MBWAD
- AG-A-38915
- CTK6H5096
- Piperazine,1-(chloroacetyl)-4-(2-methylpropyl)-(9ci)
- AKOS003587182
- DTXSID30373976
- 713522-75-9
-
- Inchi： 1S/C10H19ClN2O/c1-9(2)8-12-3-5-13(6-4-12)10(14)7-11/h9H,3-8H2,1-2H3
- InChI Key： KAXZSNMAZHKNOA-UHFFFAOYSA-N
- SMILES： ClCC(N1CCN(CC(C)C)CC1)=O
Computed Properties
- Exact Mass: 218.11877
- Monoisotopic Mass: 218.1185909g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.5
- Topological Polar Surface Area: 23.6?2
Experimental Properties
- PSA: 23.55
Ethanone,2-chloro-1-[4-(2-methylpropyl)-1-piperazinyl]- Related Literature
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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