Chemical Properties of Bupranolol, acetylated

Bupranolol, acetylated

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InChI
InChI=1S/C18H26ClNO4/c1-12-7-8-16(19)17(9-12)23-11-15(24-14(3)22)10-20(13(2)21)18(4,5)6/h7-9,15H,10-11H2,1-6H3
InChI Key
WNAOOIQGLFGOIG-UHFFFAOYSA-N
Formula
C18H26ClNO4
SMILES
CC(=O)OC(COc1cc(C)ccc1Cl)CN(C(C)=O)C(C)(C)C
Molecular Weight1
355.86
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Physical Properties

Property Value Unit Source
Δf -174.76 kJ/mol Joback Calculated Property
Δfgas -653.10 kJ/mol Joback Calculated Property
Δfus 37.49 kJ/mol Joback Calculated Property
Δvap 82.32 kJ/mol Joback Calculated Property
log10WS -4.37 Crippen Calculated Property
logPoct/wat 3.606 Crippen Calculated Property
McVol 277.820 ml/mol McGowan Calculated Property
Pc 1519.94 kPa Joback Calculated Property
Inp 2370.00 NIST
Tboil 846.66 K Joback Calculated Property
Tc 1059.32 K Joback Calculated Property
Tfus 538.21 K Joback Calculated Property
Vc 1.034 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [830.77; 903.16] J/mol×K [846.66; 1059.32] Show Hide
Cp,gas 830.77 J/mol×K 846.66 Joback Calculated Property
Cp,gas 845.54 J/mol×K 882.10 Joback Calculated Property
Cp,gas 859.17 J/mol×K 917.55 Joback Calculated Property
Cp,gas 871.70 J/mol×K 952.99 Joback Calculated Property
Cp,gas 883.18 J/mol×K 988.43 Joback Calculated Property
Cp,gas 893.65 J/mol×K 1023.88 Joback Calculated Property
Cp,gas 903.16 J/mol×K 1059.32 Joback Calculated Property

Similar Compounds

Bupranolol, hydroxy, acetylated. Bunitrolol, acetylated. Toliprolol, TFA. Toliprolol, HFB. Bunitrolol hydroxy, methoxy, acetylated. Toliprolol hydroxy, acetylated. Bunitrolol hydroxy, acetylated. Alprenolol, N,O-di(acetyl)-. 2-Acetoxy-3-(2-cyclopentylphenoxy)propylamine, N-acetyl-N-tert butyl-. Atenolol diacetate. Penbutolol hydroxy, acetylated. 2-Acetoxy-1-(N-acetyl-N-isopropyl)amino-3-(4-acetoxy-2-allylphenoxy)propane. Metipranolol, desacetyl, acetylated. Alprenolol, HFB. 1-(2-Acetoxyethyl)-4-[2-acetoxy-3-acetyl(isopropyl)aminopropyl]benzene.

Find more compounds similar to Bupranolol, acetylated.

Sources

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