Cas no 113845-71-9 (1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine)
![1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine structure](https://ossimg.kuujia.com/scimg/114000/113845-71-9x500.png)
113845-71-9 structure
Product Name:1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine
CAS No:113845-71-9
MF:C12H11F6N
MW:283.212864160538
CID:2611764
PubChem ID:2803777
Update Time:2025-04-21
1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine Chemical and Physical Properties
Names and Identifiers
-
- 1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine
- SCHEMBL19011735
- Maybridge1_002646
- DTXSID80384411
- CDS1_000358
- HMS549A06
- DivK1c_001398
- Pyrrolidine, 1-[3,5-bis(trifluoromethyl)phenyl]-
- 113845-71-9
- PGIFVSNBVXGSNX-UHFFFAOYSA-N
-
- Inchi： 1S/C12H11F6N/c13-11(14,15)8-5-9(12(16,17)18)7-10(6-8)19-3-1-2-4-19/h5-7H,1-4H2
- InChI Key： PGIFVSNBVXGSNX-UHFFFAOYSA-N
- SMILES： FC(C1C=C(C(F)(F)F)C=C(C=1)N1CCCC1)(F)F
Computed Properties
- Exact Mass: 283.07956833Da
- Monoisotopic Mass: 283.07956833Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 282
- 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: 4.3
- Topological Polar Surface Area: 3.2?2
1-[3,5-bis(trifluoromethyl)phenyl]pyrrolidine Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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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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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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