Chemical Properties of 4-iodo-2,5-dimethoxy-«beta»-phenethylamine, TFA

4-iodo-2,5-dimethoxy-«beta»-phenethylamine, TFA

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InChI
InChI=1S/C12H13F3INO3/c1-19-9-6-8(16)10(20-2)5-7(9)3-4-17-11(18)12(13,14)15/h5-6H,3-4H2,1-2H3,(H,17,18)
InChI Key
ANNXCJDPSSBHSR-UHFFFAOYSA-N
Formula
C12H13F3INO3
SMILES
COc1cc(CCNC(=O)C(F)(F)F)c(OC)cc1I
Molecular Weight1
403.14
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Physical Properties

Property Value Unit Source
Δf -639.32 kJ/mol Joback Calculated Property
Δfgas -932.65 kJ/mol Joback Calculated Property
Δfus 35.02 kJ/mol Joback Calculated Property
Δvap 70.20 kJ/mol Joback Calculated Property
log10WS -4.13 Crippen Calculated Property
logPoct/wat 2.529 Crippen Calculated Property
McVol 210.600 ml/mol McGowan Calculated Property
Pc 2104.20 kPa Joback Calculated Property
Inp 2100.00 NIST
Tboil 752.18 K Joback Calculated Property
Tc 965.84 K Joback Calculated Property
Tfus 498.28 K Joback Calculated Property
Vc 0.807 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [543.77; 599.13] J/mol×K [752.18; 965.84] Show Hide
Cp,gas 543.77 J/mol×K 752.18 Joback Calculated Property
Cp,gas 554.98 J/mol×K 787.79 Joback Calculated Property
Cp,gas 565.35 J/mol×K 823.40 Joback Calculated Property
Cp,gas 574.93 J/mol×K 859.01 Joback Calculated Property
Cp,gas 583.73 J/mol×K 894.62 Joback Calculated Property
Cp,gas 591.79 J/mol×K 930.23 Joback Calculated Property
Cp,gas 599.13 J/mol×K 965.84 Joback Calculated Property

Similar Compounds

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

Find more compounds similar to 4-iodo-2,5-dimethoxy-«beta»-phenethylamine, TFA.

Sources

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