Chemical Properties of 2C-B-FLY TFA

2C-B-FLY TFA

InChI
InChI=1S/C14H13BrF3NO3/c15-10-9-3-6-21-11(9)7(8-2-5-22-12(8)10)1-4-19-13(20)14(16,17)18/h1-6H2,(H,19,20)
InChI Key
LHOPHBFOOLNLLJ-UHFFFAOYSA-N
Formula
C14H13BrF3NO3
SMILES
O=C(NCCc1c2c(c(Br)c3c1OCC3)OCC2)C(F)(F)F
Molecular Weight1
380.16
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Physical Properties

Property Value Unit Source
ΔfusH° 48.01 kJ/mol Joback Calculated Property
logPoct/wat 2.540 Crippen Calculated Property
McVol 208.740 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, 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, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [600.40; 659.58] J/mol×K [812.80; 1035.49] Show Hide
Cp,gas 600.40 J/mol×K 812.80 Joback Calculated Property
Cp,gas 611.30 J/mol×K 849.91 Joback Calculated Property
Cp,gas 621.62 J/mol×K 887.03 Joback Calculated Property
Cp,gas 631.48 J/mol×K 924.14 Joback Calculated Property
Cp,gas 641.00 J/mol×K 961.26 Joback Calculated Property
Cp,gas 650.33 J/mol×K 998.37 Joback Calculated Property
Cp,gas 659.58 J/mol×K 1035.49 Joback Calculated Property

Similar Compounds

2C-B-fly. 1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminopropane, N-methyl. 1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminopropane. 1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminopropane, N-methyl, TFA. 1-(8-Bromo-2,3,6,7-tetrahydrodibenzo[1,2-b; 4,5-b']difuran-4-yl-2-aminoethane, TFA. Sceleratine. Desoxyaxillarine. Jacoline. Tazettine. Morphinan-6-ol, 4,5-epoxy-3-methoxy-17-methyl-, (5«alpha»,6«alpha»)-. Retroisosensine. Mucronatinine. Methyldihydromorphine. Axillarine. Hydrocodone.

Find more compounds similar to 2C-B-FLY TFA.

Sources

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