Cas no 39890-96-5 (Pyridine, 3,4,5-trichloro-2-(trifluoromethyl)-)
39890-96-5 structure
Product Name:Pyridine, 3,4,5-trichloro-2-(trifluoromethyl)-
CAS No:39890-96-5
MF:C6HCl3F3N
MW:250.433048963547
CID:3965430
PubChem ID:3927076
Update Time:2025-04-22
Pyridine, 3,4,5-trichloro-2-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine, 3,4,5-trichloro-2-(trifluoromethyl)-
- 3,4,5-trichloro-2-(trifluoromethyl)pyridine
- SCHEMBL2146161
- DTXSID201260940
- 39890-96-5
- 3,4,5-trichloro-2-trifluoromethylpyridine
- AKOS004904178
- VUTUIKIUTZWSCN-UHFFFAOYSA-N
-
- Inchi: 1S/C6HCl3F3N/c7-2-1-13-5(6(10,11)12)4(9)3(2)8/h1H
- InChI Key: VUTUIKIUTZWSCN-UHFFFAOYSA-N
- SMILES: C1(C(F)(F)F)=NC=C(Cl)C(Cl)=C1Cl
Computed Properties
- Exact Mass: 248.912667Da
- Monoisotopic Mass: 248.912667Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 186
- 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: 3.7
- Topological Polar Surface Area: 12.9?2
Pyridine, 3,4,5-trichloro-2-(trifluoromethyl)- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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