Cas no 905706-44-7 (Benzenamine, 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)-)
905706-44-7 structure
Product Name:Benzenamine, 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)-
CAS No:905706-44-7
MF:C11H7ClF3N3
MW:273.641591310501
CID:2121391
Update Time:2023-08-04
Benzenamine, 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)Benzenamine
- Benzenamine, 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)-
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- Inchi： 1S/C11H7ClF3N3/c12-10-4-9(17-5-18-10)7-2-1-6(3-8(7)16)11(13,14)15/h1-5H,16H2
- InChI Key： GSDKABBPYJVAPF-UHFFFAOYSA-N
- SMILES： ClC1=CC(C2C=CC(C(F)(F)F)=CC=2N)=NC=N1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 287
- Topological Polar Surface Area: 51.8
Benzenamine, 2-(6-chloro-4-pyrimidinyl)-5-(trifluoromethyl)- Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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