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O-Desmethylcarvedilol
[CAS# 72956-44-6]

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Identification
Name O-Desmethylcarvedilol
Synonyms Demethylcarvedilol; Desmethylcarvedilol; 2-[2-[[3-(9H-Carbazol-4-Yloxy)-2-Hydroxy-Propyl]Amino]Ethoxy]Phenol
Molecular Structure CAS#: 72956-44-6, O-Desmethylcarvedilol
Molecular Formula C23H24N2O4
Molecular Weight 392.45
CAS Registry Number 72956-44-6
SMILES C1=CC=CC2=C1[NH]C3=C2C(=CC=C3)OCC(O)CNCCOC4=CC=CC=C4O
InChI 1S/C23H24N2O4/c26-16(14-24-12-13-28-21-10-4-3-9-20(21)27)15-29-22-11-5-8-19-23(22)17-6-1-2-7-18(17)25-19/h1-11,16,24-27H,12-15H2
InChIKey XAUKPPPYYOKVQJ-UHFFFAOYSA-N
Properties
Density 1.31g/cm3 (Cal.)
Boiling point 678.682°C at 760 mmHg (Cal.)
Flash point 364.254°C (Cal.)
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