Cas no 944901-79-5 (2-Chloro-6-(trifluoromethyl)pyrimidine-4-carbaldehyde)
944901-79-5 structure
Product Name:2-Chloro-6-(trifluoromethyl)pyrimidine-4-carbaldehyde
CAS No:944901-79-5
MF:C6H2ClF3N2O
MW:210.541090488434
CID:2101667
Update Time:2023-08-03
2-Chloro-6-(trifluoromethyl)pyrimidine-4-carbaldehyde Chemical and Physical Properties
Names and Identifiers
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- 2-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDINE-4-CARBALDEHYDE
- AB58808
- 2-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDINE-4-CARBALDEH
- 2-Chloro-6-(trifluoromethyl)pyrimidine-4-carbaldehyde
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- Inchi： 1S/C6H2ClF3N2O/c7-5-11-3(2-13)1-4(12-5)6(8,9)10/h1-2H
- InChI Key： QCBWFYHLWCCLNA-UHFFFAOYSA-N
- SMILES： ClC1=NC(C=O)=CC(C(F)(F)F)=N1
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 199
- Topological Polar Surface Area: 42.8
2-Chloro-6-(trifluoromethyl)pyrimidine-4-carbaldehyde Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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