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84-49-1 | 2,7-Anthracenedisulfonicacid, 9,10-dihydro-9,10-dioxo-
CAS No: 84-49-1 Catalog No: AG004S03 MDL No:MFCD00604822
Product Description
Catalog Number:
AG004S03
Chemical Name:
2,7-Anthracenedisulfonicacid, 9,10-dihydro-9,10-dioxo-
CAS Number:
84-49-1
Molecular Formula:
C14H8O8S2
Molecular Weight:
368.3385
MDL Number:
MFCD00604822
IUPAC Name:
9,10-dioxoanthracene-2,7-disulfonic acid
InChI:
InChI=1S/C14H8O8S2/c15-13-9-3-1-7(23(17,18)19)5-11(9)14(16)12-6-8(24(20,21)22)2-4-10(12)13/h1-6H,(H,17,18,19)(H,20,21,22)
InChI Key:
OKONMFPEKSWGEU-UHFFFAOYSA-N
SMILES:
O=C1c2cc(ccc2C(=O)c2c1cc(cc2)S(=O)(=O)O)S(=O)(=O)O
EC Number:
201-533-3
Properties
Complexity:
696
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 |
|---|---|
| Quinone-enhanced sonochemical production of nitric oxide from s-nitrosoglutathione. | Ultrasonics sonochemistry 20090101 |
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