Chemical Properties of 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl), isomer 2, 2TFA

4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl), isomer 2, 2TFA

InChI
InChI=1S/C15H15F6NO4/c1-3-8-6-10(25-2)9(4-5-22-12(23)14(16,17)18)7-11(8)26-13(24)15(19,20)21/h6-7H,3-5H2,1-2H3,(H,22,23)
InChI Key
SFHBXMUAOKRMRE-UHFFFAOYSA-N
Formula
C15H15F6NO4
SMILES
CCc1cc(OC)c(CCNC(=O)C(F)(F)F)cc1OC(=O)C(F)(F)F
Molecular Weight1
387.27
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Physical Properties

Property Value Unit Source
ΔfusH° 43.39 kJ/mol Joback Calculated Property
logPoct/wat 2.946 Crippen Calculated Property
McVol 233.930 ml/mol McGowan Calculated Property
Inp [1810.00; 1810.00]   Show Hide
Inp 1810.00 NIST
Inp 1810.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [369.21; 763.42] 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 A4.29030e+01
Coefficient B1.42404e+00
Coefficient C-8.88580e-04
Coefficient D1.85060e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 369.21 J/mol×K 273.00 Calculated Property
Cp,gas 443.68 J/mol×K 353.78 Calculated Property
Cp,gas 509.12 J/mol×K 434.56 Calculated Property
Cp,gas 566.11 J/mol×K 515.33 Calculated Property
Cp,gas 615.23 J/mol×K 596.11 Calculated Property
Cp,gas 657.09 J/mol×K 676.89 Calculated Property
Cp,gas 692.24 J/mol×K 757.67 Calculated Property
Cp,gas 721.30 J/mol×K 838.44 Calculated Property
Cp,gas 744.83 J/mol×K 919.22 Calculated Property
Cp,gas 763.42 J/mol×K 1000.00 Calculated Property

Similar Compounds

2-(2-Trifluoroacetoxy-5-methoxy-4-ethylphenyl)ethylamine, N-trifluoroacetyl-. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl), bisTFA, II. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl), bisTFA, I. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, II. 2-(2,5-Dimethoxy-4-ethylphenyl)ethylamine, N-trifluoroacetyl-. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, I. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine, TFA. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-), 2TFA. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-oxo-N-acetyl-), TFA. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-N-acetyl)-isomer 2, acetylated. 2-(2-Acetoxy-5-methoxy-4-ethylphenyl)ethylamine, N-acetyl-. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-), isomer 2, di-TFA. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-), isomer 1, di-TFA. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-N-acetyl-), 2TFA. 2-(2,5-Dimethoxy-4-ethylphenyl)ethylamine, N-acetyl-.

Find more compounds similar to 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl), isomer 2, 2TFA.

Sources

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