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Piroxantrone
[CAS# 91441-23-5]

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Identification
Name Piroxantrone
Synonyms Oxantrazole; Piroxantrona [Inn-Spanish]; Piroxantronum [Inn-Latin]
Molecular Structure CAS#: 91441-23-5, Piroxantrone
Molecular Formula C21H25N5O4
Molecular Weight 411.46
CAS Registry Number 91441-23-5
SMILES C1=CC(=C3C2=C1N(NC2=C4C(=C3O)C(=O)C=CC4=O)CCNCCO)NCCCN
InChI 1S/C21H25N5O4/c22-6-1-7-24-12-2-3-13-17-16(12)21(30)19-15(29)5-4-14(28)18(19)20(17)25-26(13)10-8-23-9-11-27/h2-5,23-25,27,30H,1,6-11,22H2
InChIKey KDRKQBMPDQDAJW-UHFFFAOYSA-N
Properties
Density 1.436g/cm3 (Cal.)
Boiling point 785.023°C at 760 mmHg (Cal.)
Flash point 428.567°C (Cal.)
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