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117-14-6 | 1,5-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-
CAS No: 117-14-6 Catalog No: AG000DHS MDL No:
Product Description
Catalog Number:
AG000DHS
Chemical Name:
1,5-Anthracenedisulfonic acid, 9,10-dihydro-9,10-dioxo-
CAS Number:
117-14-6
Molecular Formula:
C14H8O8S2
Molecular Weight:
368.3385
IUPAC Name:
9,10-dioxoanthracene-1,5-disulfonic acid
InChI:
InChI=1S/C14H8O8S2/c15-13-7-3-1-5-9(23(17,18)19)11(7)14(16)8-4-2-6-10(12(8)13)24(20,21)22/h1-6H,(H,17,18,19)(H,20,21,22)
InChI Key:
OZTBHAGJSKTDGM-UHFFFAOYSA-N
SMILES:
O=C1c2cccc(c2C(=O)c2c1c(ccc2)S(=O)(=O)O)S(=O)(=O)O
EC Number:
204-177-7
UNII:
5461Q8F687
NSC Number:
201
Properties
Complexity:
692
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
367.966g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
368.33g/mol
Monoisotopic Mass:
367.966g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
160A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Reduction of Cr(VI) by Escherichia coli BL21 in the presence of redox mediators. | Bioresource technology 20121101 |
| Bis(1,10-phenanthrolin-1-ium) 9,10-di-oxo-9,10-dihydroanthracene-1,5-disul-fonate hexa-hydrate. | Acta crystallographica. Section E, Structure reports online 20110201 |
| Aqua-(9,10-dioxoanthracene-1,5-disul-fonato-κO)bis-(1,10-phenanthroline-κN,N')nickel(II). | Acta crystallographica. Section E, Structure reports online 20101001 |
| catena-Poly[[bis-(2,2'-bipyridine-κN,N')cadmium(II)]-μ-9,10-dioxo-anthracene-1,5-disulfonato-κO:O]. | Acta crystallographica. Section E, Structure reports online 20091201 |
| catena-Poly[[[bis-(1,10-phenanthroline-κN,N')manganese(II)]-μ-9,10-dioxo-anthracene-1,5-disulfonato-κO:O] tetra-hydrate]. | Acta crystallographica. Section E, Structure reports online 20090601 |
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