Chemical Properties of Nadolol, N-methyl-, trimethyl ether

Nadolol, N-methyl-, trimethyl ether

InChI
InChI=1S/C21H35NO4/c1-21(2,3)22(4)13-16(23-5)14-26-18-10-8-9-15-11-19(24-6)20(25-7)12-17(15)18/h8-10,16,19-20H,11-14H2,1-7H3
InChI Key
DENMCGUBHQWEEP-UHFFFAOYSA-N
Formula
C21H35NO4
SMILES
COC(COc1cccc2c1CC(OC)C(OC)C2)CN(C)C(C)(C)C
Molecular Weight1
365.51
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Physical Properties

Property Value Unit Source
ΔfusH° 37.35 kJ/mol Joback Calculated Property
log10WS -2.09 Relay (1.0) Calculated Property
logPoct/wat 2.939 Crippen Calculated Property
McVol 305.590 ml/mol McGowan Calculated Property
Inp [2523.80; 2523.80]   Show Hide
Inp 2523.80 NIST
Inp 2523.80 NIST
Tfus 323.25 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [448.10; 1080.34] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-5.77800e+00
Coefficient B1.91864e+00
Coefficient C-9.77720e-04
Coefficient D1.45200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 448.10 J/mol×K 273.00 Calculated Property
Cp,gas 557.05 J/mol×K 353.78 Calculated Property
Cp,gas 655.26 J/mol×K 434.56 Calculated Property
Cp,gas 743.18 J/mol×K 515.33 Calculated Property
Cp,gas 821.27 J/mol×K 596.11 Calculated Property
Cp,gas 889.99 J/mol×K 676.89 Calculated Property
Cp,gas 949.80 J/mol×K 757.67 Calculated Property
Cp,gas 1001.15 J/mol×K 838.44 Calculated Property
Cp,gas 1044.51 J/mol×K 919.22 Calculated Property
Cp,gas 1080.34 J/mol×K 1000.00 Calculated Property

Similar Compounds

Nadolol, acetylated. Moexipril Me. Moexipril desethyl 3Me (Moexprilate 3Me). Quinapril desethyl 3Me (Quinaprilate 3Me). (1,S,2S,3R,5S)-(+)-Pinanediol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. 6-O,N-Diacetylnorcodeine. Crinan-11-ol, 1,2-didehydro-3-methoxy-, (3«beta»,5«alpha»,11R,13«beta»,19«alpha»)-. Ethylmorphine. [2,2'-Bimorphinan]-3,3',6,6'-tetrol, 7,7',8,8'-tetradehydro-4,5:4',5'-diepoxy-17,17'-dimethyl-, (5«alpha»,6«alpha»)-(5'«alpha»,6'«alpha»)-. Ajmaline. Morphinan-3,6-diol, 7,8-didehydro-4,5-epoxy-17-methyl- (5«alpha»,6«alpha»)-, bis(trifluoroacetate) (ester). Methysergide. DIHYDROERGOKRYPTINE. Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, acetate (ester), (5«alpha»,6«alpha»)-. Neopine.

Find more compounds similar to Nadolol, N-methyl-, trimethyl ether.

Sources

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