Chrysamminic acid structure

Chrysamminic acid

1,8-dihydroxy-2,4,5,7-tetranitroanthracene-9,10-dione

Also Known As: Chrysamminic acid|Chrysammic acid|2,4,5,7-Tetranitrochrysazin|2,5,7-Tetranitrochrysazin|CHRYSAMMINIC ACID [MI]|1,8-Dihydroxy-2,4,5,7-tetranitroanthraquinone|EINECS 208-246-2|1,4,5,7-tetranitroanthraquinone|1,8-dihydroxy-2,4,5,7-tetranitroanthracene-9,10-dione|NCGC00160560-01|9, 1,8-dihydroxy-2,4,5,7-tetranitro-|9,10-Anthracenedione, 1,8-dihydroxy-2,4,5,7-tetranitro-|Anthraquinone,8-dihydroxy-2,4,5,7-tetranitro-|1,8-dihydroxy-2,4,5,7-tetranitro-9,10-anthraquinone|1,8-DIHYDROXY-2,4,5,7-TETRANITRO-9,10-ANTHRACENEDIONE|ANTHRAQUINONE, 1,8-DIHYDROXY-2,4,5,7-TETRANITRO-|1,8-dihydroxy-2,4,5,7-tetranitroanthra-9,10-quinone|9,10-Anthracenedione,1,8-dihydroxy-2,4,5,7-tetranitro-|Anthraquinone, 1,8-dihydroxy-2,4,5,7-tetranitro-(8CI)|1,8-Dihydroxy-2,4,5,7-tetranitroanthraquinone (chrysamminic acid)|9,10-Anthracenedione, 1,8-dihydroxy-2,4,5,7-tetranitro-(9CI)|1,8-DIHYDROXY-2,4,5,7-TETRANITRO-9,10-DIHYDROANTHRACENE-9,10-DIONE|1,8-Dihydroxy-2,4,5,7-tetranitroanthraquinone (chrysamminic acid) [Forbidden]|208-246-2

CAS: 517-92-0
Molecular Formula C14H4N4O12
Molecular Weight 419.98257 g/mol
LogP 1.506
Topological Polar Surface Area 247.16 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 12
Rotatable Bonds 4
Exact Mass 419.98257
Monoisotopic Mass 419.98257
Heavy Atoms 30
Complexity 1171.0444

Chemical Identifiers

CAS Number 517-92-0
SMILES C1=C(C2=C(C(=C1[N+](=O)[O-])O)C(=O)C3=C(C2=O)C(=CC(=C3O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Product Overview

Chrysamminic acid (CAS 517-92-0), with molecular formula C14H4N4O12 and molecular weight 419.98257 g/mol. IUPAC: 1,8-dihydroxy-2,4,5,7-tetranitroanthracene-9,10-dione.

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