Cas no 61583-27-5 ( )
structure
Product Name:
CAS No:61583-27-5
MF:C14H10Cl2F6N2Pt
MW:586.217025279999
CID:954756
PubChem ID:430435
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
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- dichloroplatinum(2+),[3-(trifluoromethyl)phenyl]azanide
- NSC274970
- NSC-274970
- 61583-27-5
-
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- Inchi： 1S/2C7H5F3N.2ClH.Pt/c2*8-7(9,10)5-2-1-3-6(11)4-5;;;/h2*1-4,11H;2*1H;/q2*-1;;;+4/p-2
- InChI Key： VMYNCEQLXHGBCH-UHFFFAOYSA-L
- SMILES： [Pt+2](Cl)Cl.FC(C1=CC=CC(=C1)[NH-])(F)F.FC(C1=CC=CC(=C1)[NH-])(F)F
Computed Properties
- Exact Mass: 579.9727
- Monoisotopic Mass: 584.977
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 25
- Rotatable Bond Count: 0
- Complexity: 325
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 2?2
Experimental Properties
- Boiling Point: 187°C at 760 mmHg
- Flash Point: 85°C
- PSA: 47.6
- LogP: 6.68570
Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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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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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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