2-[[4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]Phenyl]Amino]-5-Chlorocyclohepta-2,4,6-Trien-1-One
[CAS# 38767-88-3]

Identification

• Name: 2-[[4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]Phenyl]Amino]-5-Chlorocyclohepta-2,4,6-Trien-1-One
• Synonyms: 2-[[4-[3-(Tert-Butylamino)-2-Hydroxy-Propoxy]Phenyl]Amino]-5-Chloro-Cyclohepta-2,4,6-Trien-1-One; 2-[[4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]Phenyl]Amino]-5-Chloro-1-Cyclohepta-2,4,6-Trienone; 2,4,6-Cycloheptatrien-1-One, 5-Chloro-2-((4-(3-((1,1-Dimethylethyl)Amino)-2-Hydroxypropoxy)Phenyl)Amino)-
• Molecular Formula: C₂₀H₂₅ClN₂O₃
• Molecular Weight: 376.88
• CAS Registry Number: 38767-88-3
• SMILES: C1=C(OCC(CNC(C)(C)C)O)C=CC(=C1)NC2=CC=C(C=CC2=O)Cl
• InChI: 1S/C20H25ClN2O3/c1-20(2,3)22-12-16(24)13-26-17-8-6-15(7-9-17)23-18-10-4-14(21)5-11-19(18)25/h4-11,16,22,24H,12-13H2,1-3H3,(H,23,25)
• InChIKey: SLOFMNJNPTZBKE-UHFFFAOYSA-N

Properties

• Density: 1.225g/cm³ (Cal.)
• Boiling point: 558.8°C at 760 mmHg (Cal.)
• Flash point: 291.752°C (Cal.)