Chemical Properties of Benzeneethanamine,2,5-dimethoxy-«alpha»-methyl-4-(methylthio)-(.+/-.)- (CAS 69519-59-1)

Benzeneethanamine,2,5-dimethoxy-«alpha»-methyl-4-(methylthio)-(.+/-.)-

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InChI
InChI=1S/C12H19NO2S/c1-8(13)5-9-6-11(15-3)12(16-4)7-10(9)14-2/h6-8H,5,13H2,1-4H3
InChI Key
COBYBOVXXDQRAU-UHFFFAOYSA-N
Formula
C12H19NO2S
SMILES
COc1cc(SC)c(OC)cc1CC(C)N
Molecular Weight1
241.35
CAS
69519-59-1
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Physical Properties

Property Value Unit Source
Δf 20.81 kJ/mol Joback Calculated Property
Δfgas -282.95 kJ/mol Joback Calculated Property
Δfus 27.89 kJ/mol Joback Calculated Property
Δvap 68.46 kJ/mol Joback Calculated Property
IE 7.64 ± 0.06 eV NIST
log10WS -3.22 Crippen Calculated Property
logPoct/wat 2.315 Crippen Calculated Property
McVol 194.250 ml/mol McGowan Calculated Property
Pc 2412.37 kPa Joback Calculated Property
Tboil 701.29 K Joback Calculated Property
Tc 928.12 K Joback Calculated Property
Tfus 436.10 K Joback Calculated Property
Vc 0.713 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [518.01; 594.39] J/mol×K [701.29; 928.12] Show Hide
Cp,gas 518.01 J/mol×K 701.29 Joback Calculated Property
Cp,gas 533.23 J/mol×K 739.10 Joback Calculated Property
Cp,gas 547.47 J/mol×K 776.90 Joback Calculated Property
Cp,gas 560.73 J/mol×K 814.71 Joback Calculated Property
Cp,gas 572.97 J/mol×K 852.51 Joback Calculated Property
Cp,gas 584.20 J/mol×K 890.32 Joback Calculated Property
Cp,gas 594.39 J/mol×K 928.12 Joback Calculated Property

Similar Compounds

4-Methylthio-2-5-dimethoxyamphetamine. Brolamfetamine. Benzeneethanamine, 2,5-dimethoxy-«alpha»,4-dimethyl-. Benzeneethanamine, 2,5-dimethoxy-«alpha»,4-dimethyl-. Benzeneethanamine, 2,5-dimethoxy-«alpha»-methyl-. Phenethylamine, 2,5-dimethoxy-4-propylthio, N-trifluoroacetyl. N-Trifluoroacetyl-2,5-dimethoxy-4-trifluoroacetoxypropylthio-«beta»-phenethylamine. Phenethylamine, 2,5-dimethoxy-4-methylthio, N-acetyl. Phenethylamine, 2-methoxy-«alpha»-methyl-4,5-(methylenedioxy)-. Benzeneethanamine,2,4,5-trimethoxy-«alpha»-methyl-(.+/-.)-. Phenethylamine, 2,4,5-trimethoxy-«alpha»-methyl-. Phenethylamine, 2,5-dimethoxy-4-propylthio, N-methylene. 3,4-Methylenedioxy-2-methoxyamphetamine. 2,3-Dimethoxyamphetamine. Phenethylamine, 2,5-dimethoxy-4-methylthio, sulfoxide, N-acetyl.

Find more compounds similar to Benzeneethanamine,2,5-dimethoxy-«alpha»-methyl-4-(methylthio)-(.+/-.)-.

Sources

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