1,4-Diamino-2-Chloro-3-[(2-Hydroxyethyl)Thio]-9,10-Anthracenedione
[CAS# 58065-21-7]

Identification

• Name: 1,4-Diamino-2-Chloro-3-[(2-Hydroxyethyl)Thio]-9,10-Anthracenedione
• Synonyms: 1,4-Diamino-2-Chloro-3-(2-Hydroxyethylthio)Anthracene-9,10-Dione; 1,4-Diamino-2-Chloro-3-(2-Hydroxyethylthio)-9,10-Anthraquinone; 9,10-Anthracenedione, 1,4-Diamino-2-Chloro-3-((2-Hydroxyethyl)Thio)-
• Molecular Formula: C₁₆H₁₃ClN₂O₃S
• Molecular Weight: 348.80
• CAS Registry Number: 58065-21-7
• SMILES: C1=CC=CC3=C1C(C2=C(C(=C(SCCO)C(=C2C3=O)N)Cl)N)=O
• InChI: 1S/C16H13ClN2O3S/c17-11-12(18)9-10(13(19)16(11)23-6-5-20)15(22)8-4-2-1-3-7(8)14(9)21/h1-4,20H,5-6,18-19H2
• InChIKey: RNBCULCDJNYBTF-UHFFFAOYSA-N

Properties

• Density: 1.597g/cm³ (Cal.)
• Boiling point: 647.994°C at 760 mmHg (Cal.)
• Flash point: 345.695°C (Cal.)