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Home > Nitro Compounds > 82-34-8
82-34-8 | 1-Nitroanthracene-9,10-dione
CAS No: 82-34-8 Catalog No: AG003EKD MDL No:MFCD00019140
Product Description
Catalog Number:
AG003EKD
Chemical Name:
1-Nitroanthracene-9,10-dione
CAS Number:
82-34-8
Molecular Formula:
C14H7NO4
Molecular Weight:
253.2097
MDL Number:
MFCD00019140
IUPAC Name:
1-nitroanthracene-9,10-dione
InChI:
InChI=1S/C14H7NO4/c16-13-8-4-1-2-5-9(8)14(17)12-10(13)6-3-7-11(12)15(18)19/h1-7H
InChI Key:
YCANAXVBJKNANM-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2C(=O)c2c1cccc2[N+](=O)[O-]
EC Number:
201-413-0
NSC Number:
12125
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.038g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.213g/mol
Monoisotopic Mass:
253.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Photoreduction of 2-methyl-1-nitro-9,10-anthraquinone in the presence of 1-phenylethanol. | Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20081101 |
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