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Home > Nitro Compounds > 65266-00-4
65266-00-4 | 9,10-Anthracenedione, 4-hydroxy-1,5-dinitro-
CAS No: 65266-00-4 Catalog No: AG00H662 MDL No:
Product Description
Catalog Number:
AG00H662
Chemical Name:
9,10-Anthracenedione, 4-hydroxy-1,5-dinitro-
CAS Number:
65266-00-4
Molecular Formula:
C14H6N2O7
Molecular Weight:
314.2066
IUPAC Name:
4-hydroxy-1,5-dinitroanthracene-9,10-dione
InChI:
InChI=1S/C14H6N2O7/c17-9-5-4-8(16(22)23)11-12(9)14(19)10-6(13(11)18)2-1-3-7(10)15(20)21/h1-5,17H
InChI Key:
FHTARGUSXWEOCY-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c2c1C(=O)c1cccc(c1C2=O)[N+](=O)[O-])O
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.018g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
314.209g/mol
Monoisotopic Mass:
314.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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