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

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

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InChI
InChI=1S/C13H16INO4/c1-8(16)15-5-4-10-6-13(19-9(2)17)11(14)7-12(10)18-3/h6-7H,4-5H2,1-3H3,(H,15,16)
InChI Key
XWGSBNZEABPUNF-UHFFFAOYSA-N
Formula
C13H16INO4
SMILES
COc1cc(I)c(OC(C)=O)cc1CCNC(C)=O
Molecular Weight1
377.17
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Physical Properties

Property Value Unit Source
ΔfG° -178.23 kJ/mol Joback Calculated Property
ΔfH°gas -468.79 kJ/mol Joback Calculated Property
ΔfusH° 37.38 kJ/mol Joback Calculated Property
ΔvapH° 82.91 kJ/mol Joback Calculated Property
log10WS -3.66 Crippen Calculated Property
logPoct/wat 1.904 Crippen Calculated Property
McVol 220.950 ml/mol McGowan Calculated Property
Pc 2274.07 kPa Joback Calculated Property
Inp 2500.00 NIST
Tboil 834.35 K Joback Calculated Property
Tc 1065.10 K Joback Calculated Property
Tfus 555.29 K Joback Calculated Property
Vc 0.827 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [581.59; 634.89] J/mol×K [834.35; 1065.10] Show Hide
Cp,gas 581.59 J/mol×K 834.35 Joback Calculated Property
Cp,gas 592.96 J/mol×K 872.81 Joback Calculated Property
Cp,gas 603.33 J/mol×K 911.27 Joback Calculated Property
Cp,gas 612.71 J/mol×K 949.72 Joback Calculated Property
Cp,gas 621.09 J/mol×K 988.18 Joback Calculated Property
Cp,gas 628.48 J/mol×K 1026.64 Joback Calculated Property
Cp,gas 634.89 J/mol×K 1065.10 Joback Calculated Property

Similar Compounds

4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-), isomer 1, diacetylated. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-), isomer 2, di-TFA. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine, TFA. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-N-acetyl-), isomer-2. 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 1, di-TFA. 4-iodo-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-N-acetyl-), isomer-1. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (hydroxyl-N-acetyl)-isomer 2, acetylated. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (OH-N-acetyl-), isomer 2, propionylated. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (hydroxyl-N-acetyl)-isomer 1, acetylated. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, II. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (HO-N-acetyl-), isomer 1, propionylated. 4-ethyl-2,5-dimethoxy-«beta»-phenethylamine-M, (O-desmethyl-oxo-N-acetyl-), TFA. 2,5-Dimethoxy-4-methyl-«beta»-phenethylamine-M (O-desmethyl-N-acetyl-), TFA, I.

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

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