Cas no 877383-59-0 (1-(4-bromo-2-chlorobenzoyl)azetidine)
877383-59-0 structure
Product Name:1-(4-bromo-2-chlorobenzoyl)azetidine
CAS No:877383-59-0
MF:C10H9BrClNO
MW:274.54156088829
CID:2138444
PubChem ID:57664676
Update Time:2025-04-21
1-(4-bromo-2-chlorobenzoyl)azetidine Chemical and Physical Properties
Names and Identifiers
-
- 1-(4-bromo-2-chlorobenzoyl)azetidine
- 877383-59-0
- SCHEMBL3342742
- OWRRFHGMCWNHRE-UHFFFAOYSA-N
- DB-336734
-
- Inchi： 1S/C10H9BrClNO/c11-7-2-3-8(9(12)6-7)10(14)13-4-1-5-13/h2-3,6H,1,4-5H2
- InChI Key： OWRRFHGMCWNHRE-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)Cl)C(N1CCC1)=O
Computed Properties
- Exact Mass: 272.95560Da
- Monoisotopic Mass: 272.95560Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 232
- 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: 2.8
- Topological Polar Surface Area: 20.3?2
1-(4-bromo-2-chlorobenzoyl)azetidine Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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