Cas no 77367-94-3 (Piperazine, 1-(dichloroacetyl)-4-(4-nitrophenyl)-)
77367-94-3 structure
Product Name:Piperazine, 1-(dichloroacetyl)-4-(4-nitrophenyl)-
CAS No:77367-94-3
MF:C12H13Cl2N3O3
MW:318.155920743942
CID:536245
PubChem ID:2837846
Update Time:2025-04-19
Piperazine, 1-(dichloroacetyl)-4-(4-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Piperazine, 1-(dichloroacetyl)-4-(4-nitrophenyl)-
- 2,2-dichloro-1-[4-(4-nitrophenyl)piperazin-1-yl]ethanone
- 77367-94-3
- QZSWOUHAFDFMTK-UHFFFAOYSA-N
- SR-01000201356
- ST50911991
- SR-01000201356-1
- Cambridge id 5256912
- DTXSID40385525
- 2,2-dichloro-1-(4-(4-nitrophenyl)piperazine-1-yl)ethan-1-one
- 1-(4-nitrophenyl)-4-dichloroacetyl-piperazine
- 1-(dichloroacetyl)-4-(4-nitrophenyl)piperazine
- AKOS003277507
- SCHEMBL11194107
-
- Inchi： 1S/C12H13Cl2N3O3/c13-11(14)12(18)16-7-5-15(6-8-16)9-1-3-10(4-2-9)17(19)20/h1-4,11H,5-8H2
- InChI Key： QZSWOUHAFDFMTK-UHFFFAOYSA-N
- SMILES： ClC(C(N1CCN(C2C=CC(=CC=2)[N+](=O)[O-])CC1)=O)Cl
Computed Properties
- Exact Mass: 317.0333967g/mol
- Monoisotopic Mass: 317.0333967g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 359
- 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: 2.5
- Topological Polar Surface Area: 69.4?2
Piperazine, 1-(dichloroacetyl)-4-(4-nitrophenyl)- Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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