Cas no 676227-04-6 (1-(Chloromethylidene)piperazin-1-ium chloride)
676227-04-6 structure
Product Name:1-(Chloromethylidene)piperazin-1-ium chloride
CAS No:676227-04-6
MF:C5H10Cl2N2
MW:169.052299022675
CID:2798026
PubChem ID:71367926
Update Time:2025-04-21
1-(Chloromethylidene)piperazin-1-ium chloride Chemical and Physical Properties
Names and Identifiers
-
- 1-(Chloromethylidene)piperazin-1-ium chloride
- 676227-04-6
- DTXSID60791023
-
- Inchi： 1S/C5H10ClN2.ClH/c6-5-8-3-1-7-2-4-8;/h5,7H,1-4H2;1H/q+1;/p-1
- InChI Key： UMYHOKQHGKIZOB-UHFFFAOYSA-M
- SMILES： Cl/C=[N+]1/CCNCC/1.[Cl-]
Computed Properties
- Exact Mass: 168.0221037Da
- Monoisotopic Mass: 168.0221037Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 92.6
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 15?2
1-(Chloromethylidene)piperazin-1-ium chloride Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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