But-2-Enedioic Acid; N,N,2-Trimethyl-3-(2-Methylsulfanylphenothiazin-10-Yl)Propan-1-Amine
[CAS# 1057-84-7]

Identification

• Name: But-2-Enedioic Acid; N,N,2-Trimethyl-3-(2-Methylsulfanylphenothiazin-10-Yl)Propan-1-Amine
• Synonyms: But-2-Enedioic Acid; N,N,2-Trimethyl-3-[2-(Methylthio)-10-Phenothiazinyl]Propan-1-Amine; But-2-Enedioic Acid; Dimethyl-[2-Methyl-3-[2-(Methylthio)Phenothiazin-10-Yl]Propyl]Amine; 10-(3-(Dimethylammonio)-2-Methylpropyl)-2-(Methylthio)-10H-Phenothiazinium Maleate
• Molecular Formula: C₂₃H₂₈N₂O₄S₂
• Molecular Weight: 460.61
• CAS Registry Number: 1057-84-7
• EINECS: 213-892-3
• SMILES: C2=C1N(C3=C(SC1=CC=C2SC)C=CC=C3)CC(CN(C)C)C.O=C(O)\C=C/C(=O)O
• InChI: 1S/C19H24N2S2.C4H4O4/c1-14(12-20(2)3)13-21-16-7-5-6-8-18(16)23-19-10-9-15(22-4)11-17(19)21;5-3(6)1-2-4(7)8/h5-11,14H,12-13H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChIKey: RWHQUYWVERCNEK-BTJKTKAUSA-N

Properties

• Boiling point: 480.8°C at 760 mmHg (Cal.)
• Flash point: 244.6°C (Cal.)