Cas no 125119-07-5 (Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-)
![Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]- structure](https://ossimg.kuujia.com/scimg/125500/125119-07-5x500.png)
125119-07-5 structure
Product Name:Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-
CAS No:125119-07-5
MF:C16H16F3N3
MW:307.31355381012
CID:160065
PubChem ID:130360
Update Time:2025-04-19
Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]- Chemical and Physical Properties
Names and Identifiers
-
- Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-
- 3-methyl-6-[3-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl]pyridazine
- 3-Methyl-6-(3-(3-(trifluoromethyl)phenyl)-1-pyrrolidinyl)pyridazine
- Pyridazine, 3-methyl-6-(3-(3-(trifluoromethyl)phenyl)-1-pyrrolidinyl)-
- SCHEMBL10429405
- R 66,703
- KTOOXVVTDOFPMM-UHFFFAOYSA-N
- R-66703
- DTXSID00925027
- 3-methyl-6-{3-[3-(trifluoromethyl)phenyl]pyrrolidin-1-yl}pyridazine
- Pyridazine, 3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-
- 125119-07-5
- R 66703
-
- Inchi： 1S/C16H16F3N3/c1-11-5-6-15(21-20-11)22-8-7-13(10-22)12-3-2-4-14(9-12)16(17,18)19/h2-6,9,13H,7-8,10H2,1H3
- InChI Key： KTOOXVVTDOFPMM-UHFFFAOYSA-N
- SMILES： FC(C1=CC=CC(=C1)C1CN(C2=CC=C(C)N=N2)CC1)(F)F
Computed Properties
- Exact Mass: 307.12978
- Monoisotopic Mass: 307.12963201g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 374
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 29?2
Experimental Properties
- PSA: 29.02
Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]- Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
125119-07-5 (Pyridazine,3-methyl-6-[3-[3-(trifluoromethyl)phenyl]-1-pyrrolidinyl]-) Related Products
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