Cas no 159177-91-0 (2-Piperidinone,1-[3-(trifluoromethyl)phenyl]-)
![2-Piperidinone,1-[3-(trifluoromethyl)phenyl]- structure](https://ossimg.kuujia.com/scimg/159500/159177-91-0x500.png)
159177-91-0 structure
Product Name:2-Piperidinone,1-[3-(trifluoromethyl)phenyl]-
CAS No:159177-91-0
MF:C12H12F3NO
MW:243.22499370575
CID:137716
PubChem ID:53422124
Update Time:2025-04-19
2-Piperidinone,1-[3-(trifluoromethyl)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- 2-Piperidinone,1-[3-(trifluoromethyl)phenyl]-
- 1-[3-(trifluoromethyl)phenyl]piperidin-2-one
- 1-(3-trifluoromethyl)phenyl-2-piperidinone
- 1-(3-trifluoromethylphenyl)piperidin-2-one
- 2-Piperidinone,1-[3-(trifluoromethyl)phenyl]
- 1-(3-TRIFLUOROMETHYL-PHENYL)-PIPERIDIN-2-ONE
- UBAKVXOGCJMJPZ-UHFFFAOYSA-N
- 1-(3-(Trifluoromethyl)phenyl)piperidin-2-one
- SCHEMBL8098411
- 1-(3-Trifluoromethyl-phenyl)piperidin-2-one
- 159177-91-0
- AKOS015911103
- DTXSID50697969
-
- Inchi： 1S/C12H12F3NO/c13-12(14,15)9-4-3-5-10(8-9)16-7-2-1-6-11(16)17/h3-5,8H,1-2,6-7H2
- InChI Key： UBAKVXOGCJMJPZ-UHFFFAOYSA-N
- SMILES： FC(C1=CC=CC(=C1)N1C(CCCC1)=O)(F)F
Computed Properties
- Exact Mass: 243.08700
- Monoisotopic Mass: 243.087
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 290
- 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
- Topological Polar Surface Area: 20.3A^2
- XLogP3: 2.6
Experimental Properties
- PSA: 20.31000
- LogP: 3.28730
2-Piperidinone,1-[3-(trifluoromethyl)phenyl]- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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