1-(2-Diethylaminoethylamino)-4-Methyl-Thioxanthen-9-One; 4-Hydroxy-2-Methyl-5-Propan-2-Yl-Benzenesulfonic Acid
[CAS# 16170-88-0]

Identification

• Name: 1-(2-Diethylaminoethylamino)-4-Methyl-Thioxanthen-9-One; 4-Hydroxy-2-Methyl-5-Propan-2-Yl-Benzenesulfonic Acid
• Synonyms: 1-(2-Diethylaminoethylamino)-4-Methyl-Thioxanthen-9-One; 4-Hydroxy-5-Isopropyl-2-Methyl-Benzenesulfonic Acid; 1-(2-Diethylaminoethylamino)-4-Methyl-9-Thioxanthenone; 4-Hydroxy-5-Isopropyl-2-Methylbenzenesulfonic Acid; 1-(2-Diethylaminoethylamino)-4-Methyl-Thioxanthen-9-One; 4-Hydroxy-2-Methyl-5-Propan-2-Yl-Benzenesulfonic Acid
• Molecular Formula: C₃₀H₃₈N₂O₅S₂
• Molecular Weight: 570.76
• CAS Registry Number: 16170-88-0
• SMILES: C3=C(NCCN(CC)CC)C2=C(SC1=C(C=CC=C1)C2=O)C(=C3)C.C4=C(O)C(=CC(=C4C)[S](O)(=O)=O)C(C)C
• InChI: 1S/C20H24N2OS.C10H14O4S/c1-4-22(5-2)13-12-21-16-11-10-14(3)20-18(16)19(23)15-8-6-7-9-17(15)24-20;1-6(2)8-5-10(15(12,13)14)7(3)4-9(8)11/h6-11,21H,4-5,12-13H2,1-3H3;4-6,11H,1-3H3,(H,12,13,14)
• InChIKey: RSTDJYGDTNRVHD-UHFFFAOYSA-N

Properties

• Boiling point: 512.4°C at 760 mmHg (Cal.)
• Flash point: 263.7°C (Cal.)