Cas no 2591-21-1 (Phenol,2,4,6-trichloro-, potassium salt (1:1))
2591-21-1 structure
Product Name:Phenol,2,4,6-trichloro-, potassium salt (1:1)
CAS No:2591-21-1
MF:C6H2Cl3KO
MW:235.536779880524
CID:239765
PubChem ID:23673635
Update Time:2025-04-19
Phenol,2,4,6-trichloro-, potassium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2,4,6-trichloro-, potassium salt (1:1)
- potassium,2,4,6-trichlorophenolate
- 2,4,6-Trichlorophenol potassium salt
- Phenol, 2,4,6-trichloro-, potassium salt
- Potassium 2,4,6-trichlorophenate
- Potassium 2,4,6-trichlorophenoxide
- NS00082171
- EINECS 219-982-9
- SCHEMBL2810616
- Q27287500
- UNII-QUH80GJH3S
- Potassium 2,4,6-trichlorophenolate
- 2591-21-1
- POTASSIUM, (2,4,6-TRICHLOROPHENOXY)-
- QUH80GJH3S
- PHENOL, 2,4,6-TRICHLORO-, POTASSIUM SALT (1:1)
- DTXSID6042311
-
- Inchi： 1S/C6H3Cl3O.K/c7-3-1-4(8)6(10)5(9)2-3;/h1-2,10H;/q;+1/p-1
- InChI Key： UDTHXINPAYGVMM-UHFFFAOYSA-M
- SMILES： [K+].ClC1C=C(C=C(C=1[O-])Cl)Cl
Computed Properties
- Exact Mass: 233.88096
- Monoisotopic Mass: 233.880829g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 112
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 23.1?2
Experimental Properties
- PSA: 23.06
Phenol,2,4,6-trichloro-, potassium salt (1:1) Related Literature
-
1. 403. Exchange reactions of heavy water with organic compounds. Part I. Phenol, acetanilide, and the formate ionP. A. Small,J. H. Wolfenden J. Chem. Soc. 1936 1811
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