Cas no 116184-17-9 (Pyridinol,2,3,6-trichloro- (9CI))
116184-17-9 structure
Product Name:Pyridinol,2,3,6-trichloro- (9CI)
CAS No:116184-17-9
MF:C5H2Cl3NO
MW:198.434478282928
CID:173952
PubChem ID:189378
Update Time:2025-04-19
Pyridinol,2,3,6-trichloro- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Pyridinol,2,3,6-trichloro- (9CI)
- 2,3,6-trichloro-1H-pyridin-4-one
- 116184-17-9
- Pyridinol, 2,3,6-trichloro-
- DTXSID00151309
- 2,3,6-Trichloropyridinol
-
- Inchi： 1S/C5H2Cl3NO/c6-3-1-2(10)4(7)5(8)9-3/h1H,(H,9,10)
- InChI Key： UIZJMRPXPQUICO-UHFFFAOYSA-N
- SMILES： ClC1=C(C(C=C(N1)Cl)=O)Cl
Computed Properties
- Exact Mass: 196.92036
- Monoisotopic Mass: 196.920197g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 243
- 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
- XLogP3: 2.7
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
Pyridinol,2,3,6-trichloro- (9CI) Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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