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84682-31-5 | 9H-Thioxanthen-9-one,1-hydroxy-
CAS No: 84682-31-5 Catalog No: AG004ZSJ MDL No:
Product Description
Catalog Number:
AG004ZSJ
Chemical Name:
9H-Thioxanthen-9-one,1-hydroxy-
CAS Number:
84682-31-5
Molecular Formula:
C13H8O2S
Molecular Weight:
228.2664
IUPAC Name:
1-hydroxythioxanthen-9-one
InChI:
InChI=1S/C13H8O2S/c14-9-5-3-7-11-12(9)13(15)8-4-1-2-6-10(8)16-11/h1-7,14H
InChI Key:
OEZKDMYTQDZSAZ-UHFFFAOYSA-N
SMILES:
Oc1cccc2c1c(=O)c1c(s2)cccc1
EC Number:
283-594-6
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.025g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.265g/mol
Monoisotopic Mass:
228.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| Structure-retention and mobile phase-retention relationships for reversed-phase high-performance liquid chromatography of several hydroxythioxanthone derivatives in binary acetonitrile-water mixtures. | Analytica chimica acta 20071212 |
| Hydroxy-thioxanthones as suitable neutral ionophores for the preparation of PVC-membrane potentiometric sensors for Al(III) ion. | Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20040201 |
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