Des(isopropoxyethyl) Bisoprolol

Base Information

• Chemical Name: Des(isopropoxyethyl) Bisoprolol
• CAS No.: 62572-93-4
• Molecular Formula: C13H21NO3
• Molecular Weight: 239.31
• European Community (EC) Number: 642-118-0
• UNII: AVH64C2ZNW
• DSSTox Substance ID: DTXSID00438602
• Mol file: 62572-93-4.mol

Synonyms:Des(isopropoxyethyl) Bisoprolol;62572-93-4;Bisoprolol EP Impurity A;AVH64C2ZNW;1-[4-(hydroxymethyl)phenoxy]-3-(propan-2-ylamino)propan-2-ol;Bisoprolol fumarate impurity A;Benzenemethanol, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-;H-119/68;(RS)-1-(4-Hydroxymethylphenoxy)-3-isopropylaminopropan-2-ol;1-(4-(Hydroxymethyl)phenoxy)-3-(isopropylamino)propan-2-ol;4-[2-Hydroxy-3-[(1-methylethyl)amino]propoxy]benzenemethanol;(2RS)-1-(4-Hydroxymethyl-phenoxy)-3-isopropylaminopropan-2-ol;Benzenemethanol, 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)-;4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzenemethanol;Bisoprolol Fumarate Imp. A (EP);Bisoprolol Imp. A (EP);Bisoprolol Fumarate Impurity A;Bisoprolol Impurity A;UNII-AVH64C2ZNW;SCHEMBL2585653;DTXSID00438602;AKOS010477464;FT-0666028;Bisoprolol fumarate specified impurity A [EP];BISOPROLOL FUMARATE IMPURITY A [EP IMPURITY];(rs)-1-(4-hydroxymethyl-phenoxy)-3-isopropylaminopropan-2-ol;1-[4-(hydroxymethyl)phenoxy]-3-[(propan-2-yl)amino]propan-2-ol;Bisoprolol Hemifumarate Imp. A (EP): (RS)-1-(4-Hydroxymethyl-phenoxy)-3-isopropylaminopropan-2-ol

Chemical Property of Des(isopropoxyethyl) Bisoprolol

Chemical Property:

• Melting Point: 72-75*C
• Boiling Point: 413.2±40.0 °C(Predicted)
• PKA: 13.86±0.20(Predicted)
• PSA: 61.72000
• Density: 1.103±0.06 g/cm3(Predicted)
• LogP: 1.30750
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 239.15214353
• Heavy Atom Count: 17
• Complexity: 191

Purity/Quality:

98%Min ^*data from raw suppliers

Des(isopropoxyethyl)Bisoprolol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)NCC(COC1=CC=C(C=C1)CO)O
• Uses: Des(isopropoxyethyl) Bisoprolol (Bisoprolol EP Impurity A) is a metabolite of Metoprolol and Bisoprolol.