Cas no 3229-70-7 (Phenol, ion(1-))
Phenol, ion(1-) structure
Product Name:Phenol, ion(1-)
Phenol, ion(1-) Chemical and Physical Properties
Names and Identifiers
-
- Phenol, ion(1-)
- Phenol ion
-
- Inchi： InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/p-1
- InChI Key： ISWSIDIOOBJBQZ-UHFFFAOYSA-M
- SMILES： [O-]C1C=CC=CC=1
Computed Properties
- Exact Mass: 93.03405
- Monoisotopic Mass: 93.034
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 46.1
- 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: 1.5
- Topological Polar Surface Area: 23.1?2
Experimental Properties
- PSA: 23.06
- LogP: 1.83040
Phenol, ion(1-) Related Literature
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Pascal I. Binda,Ewan E. Delbridge,Harmon B. Abrahamson,Brian W. Skelton Dalton Trans. 2009 2777
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A. Daniel Schofield,Mariana Luna Barros,Michael G. Cushion,Andrew D. Schwarz,Philip Mountford Sodium magnesium and zinc complexes of mono(phenolate) heteroscorpionate ligands. A. Daniel Schofield Mariana Luna Barros Michael G. Cushion Andrew D. Schwarz Philip Mountford Dalton Trans. 2009 85
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Sophie Hameury,Pierre de Frémont,Pierre Braunstein Chem. Soc. Rev. 2017 46 632
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Peng Kang,Bo-Lin Lin,Tao A. G. Large,Jasper Ainsworth,Erik C. Wasinger,T. Daniel P. Stack Faraday Discuss. 2022 234 86
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Thomas R. Porter,Ellen C. Hayes,Werner Kaminsky,James M. Mayer Dalton Trans. 2017 46 2551
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