Cas no 438249-85-5 (4-Chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine)
438249-85-5 structure
Product Name:4-Chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine
CAS No:438249-85-5
MF:C9H4ClF3N4
MW:260.603070259094
CID:2642554
PubChem ID:22732367
Update Time:2025-04-21
4-Chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine Chemical and Physical Properties
Names and Identifiers
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- DTXSID101208238
- 4-chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine
- SCHEMBL5479183
- 4-chloro-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine
- 438249-85-5
- 4-chloro-2-(2-pyrazinyl)-6-trifluoromethylpyrimidine
- 4-Chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine
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- Inchi： 1S/C9H4ClF3N4/c10-7-3-6(9(11,12)13)16-8(17-7)5-4-14-1-2-15-5/h1-4H
- InChI Key： FXKIFMAMPPOOLJ-UHFFFAOYSA-N
- SMILES： ClC1=CC(C(F)(F)F)=NC(C2C=NC=CN=2)=N1
Computed Properties
- Exact Mass: 260.008
- Monoisotopic Mass: 260.008
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 263
- 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: 51.6A^2
- XLogP3: 1.6
4-Chloro-2-(2-pyrazinyl)-6-(trifluoromethyl)pyrimidine Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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