Cas no 1090429-01-8 (1-(2-Bromophenylsulfonyl)-2-methylpiperidine)
1090429-01-8 structure
Product Name:1-(2-Bromophenylsulfonyl)-2-methylpiperidine
CAS No:1090429-01-8
MF:C12H16BrNO2S
MW:318.229941368103
CID:2604889
PubChem ID:23819921
Update Time:2024-11-04
1-(2-Bromophenylsulfonyl)-2-methylpiperidine Chemical and Physical Properties
Names and Identifiers
-
- 1-(2-bromobenzenesulfonyl)-2-methylpiperidine
- 1-(2-Bromophenylsulfonyl)-2-methylpiperidine
- Oprea1_257983
- Z45548756
- AKOS008941182
- 1090429-01-8
- 1-((2-Bromophenyl)sulfonyl)-2-methylpiperidine
- AB00991524-01
- starbld0030937
- CS-0283292
-
- MDL： MFCD11729489
- Inchi： 1S/C12H16BrNO2S/c1-10-6-4-5-9-14(10)17(15,16)12-8-3-2-7-11(12)13/h2-3,7-8,10H,4-6,9H2,1H3
- InChI Key： IAMLGHHIDGPQGY-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1S(N1CCCCC1C)(=O)=O
Computed Properties
- Exact Mass: 317.00851g/mol
- Monoisotopic Mass: 317.00851g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 352
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 45.8
- XLogP3: 3
1-(2-Bromophenylsulfonyl)-2-methylpiperidine Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
-
Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
-
Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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