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Home > Indoles and Oxindole > 136623-01-3
136623-01-3 | 1H-Benz[g]indole-2,3-dione,6,7,8,9-tetrahydro-5-nitro-, 3-oxime
CAS No: 136623-01-3 Catalog No: AG0070LF MDL No:
Product Description
Catalog Number:
AG0070LF
Chemical Name:
1H-Benz[g]indole-2,3-dione,6,7,8,9-tetrahydro-5-nitro-, 3-oxime
CAS Number:
136623-01-3
Molecular Formula:
C12H11N3O4
Molecular Weight:
261.2334
IUPAC Name:
5-nitro-3-nitroso-6,7,8,9-tetrahydro-1H-benzo[g]indol-2-ol
InChI:
InChI=1S/C12H11N3O4/c16-12-11(14-17)8-5-9(15(18)19)6-3-1-2-4-7(6)10(8)13-12/h5,13,16H,1-4H2
InChI Key:
SADZJARZJNQZHT-UHFFFAOYSA-N
SMILES:
ON=C1C(=O)Nc2c1cc([N+](=O)[O-])c1c2CCCC1
UNII:
00978E5H3R
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.075g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.237g/mol
Monoisotopic Mass:
261.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Down-regulation of GluK2 kainate receptor expression by chronic treatment with mood-stabilizing anti-convulsants or lithium in cultured astrocytes and brain, but not in neurons. | Neuropharmacology 20090901 |
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