Chemical Properties of Toliprolol, TFA

Toliprolol, TFA

InChI
InChI=1S/C17H19F6NO4/c1-10(2)24(14(25)16(18,19)20)8-13(28-15(26)17(21,22)23)9-27-12-6-4-5-11(3)7-12/h4-7,10,13H,8-9H2,1-3H3
InChI Key
RKNLDVQEQLJGFY-UHFFFAOYSA-N
Formula
C17H19F6NO4
SMILES
Cc1cccc(OCC(CN(C(=O)C(F)(F)F)C(C)C)OC(=O)C(F)(F)F)c1
Molecular Weight1
415.33
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Physical Properties

Property Value Unit Source
ΔfusH° 38.64 kJ/mol Joback Calculated Property
logPoct/wat 3.647 Crippen Calculated Property
McVol 262.110 ml/mol McGowan Calculated Property
Inp 1728.00 NIST

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Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [795.90; 863.20] J/mol×K [773.32; 958.90] Show Hide
Cp,gas 795.90 J/mol×K 773.32 Joback Calculated Property
Cp,gas 809.33 J/mol×K 804.25 Joback Calculated Property
Cp,gas 821.80 J/mol×K 835.18 Joback Calculated Property
Cp,gas 833.38 J/mol×K 866.11 Joback Calculated Property
Cp,gas 844.11 J/mol×K 897.04 Joback Calculated Property
Cp,gas 854.03 J/mol×K 927.97 Joback Calculated Property
Cp,gas 863.20 J/mol×K 958.90 Joback Calculated Property

Similar Compounds

Toliprolol, HFB. Alprenolol, N,O-di(trifluoroacetyl)-. Toliprolol hydroxy, acetylated. PROPRANOLOL BIS(TRIFLUOROACETATE). Oxprenolol, TFA. Alprenolol, N,O-di(acetyl)-. Atenolol diacetate. Alprenolol, N,O-di(heptafluorobutyryl)-. Bupranolol, acetylated. Oxprenolol, HFB. Metipranolol, desacetyl, acetylated. 1-(2-Acetoxyethyl)-4-[2-acetoxy-3-acetyl(isopropyl)aminopropyl]benzene. Metoprolol, HFB. 2-Acetoxy-1-(N-acetyl-N-isopropyl)amino-3-(4-acetoxy-2-allylphenoxy)propane. 2-Acetoxy-1-(N-acetyl-N-isopropyl)amino-3-[4-(2-cyclopropylmethoxyethyl)phenoxy]propane.

Find more compounds similar to Toliprolol, TFA.

Sources

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