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Home > Nitro Compounds > 189571-32-2
189571-32-2 | 9,10-Anthracenedione, 4-hydroxy-1-(2-nitrosohydrazinyl)-2-phenoxy-
CAS No: 189571-32-2 Catalog No: AG002DRE MDL No:
Product Description
Catalog Number:
AG002DRE
Chemical Name:
9,10-Anthracenedione, 4-hydroxy-1-(2-nitrosohydrazinyl)-2-phenoxy-
CAS Number:
189571-32-2
Molecular Formula:
C20H13N3O5
Molecular Weight:
375.3343
IUPAC Name:
N-(4,9,10-trihydroxy-2-phenoxyanthracen-1-yl)iminonitrous amide
InChI:
InChI=1S/C20H13N3O5/c24-14-10-15(28-11-6-2-1-3-7-11)18(21-22-23-27)17-16(14)19(25)12-8-4-5-9-13(12)20(17)26/h1-10,24-26H
InChI Key:
BFHUYUYEOWRHGF-UHFFFAOYSA-N
SMILES:
O=NNNc1c(Oc2ccccc2)cc(c2c1C(=O)c1ccccc1C2=O)O
Properties
Complexity:
570
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.086g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
375.34g/mol
Monoisotopic Mass:
375.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
124A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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