Chemical Properties of Benzenemethanamine, 2-chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluoro- (CAS 62924-70-3)

Benzenemethanamine, 2-chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluoro-

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InChI
InChI=1S/C16H12ClF4N3O4/c1-2-22(8-10-11(17)4-3-5-12(10)18)15-13(23(25)26)6-9(16(19,20)21)7-14(15)24(27)28/h3-7H,2,8H2,1H3
InChI Key
PWNAWOCHVWERAR-UHFFFAOYSA-N
Formula
C16H12ClF4N3O4
SMILES
CCN(Cc1c(F)cccc1Cl)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]
Molecular Weight1
421.73
CAS
62924-70-3
Other Names
  • 2-Chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluorobenzenemethanamine
  • CGA-41065
  • Flumetralin
  • Flumetraline
  • Prime+
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Physical Properties

Property Value Unit Source
Δf -345.94 kJ/mol Joback Calculated Property
Δfgas -720.78 kJ/mol Joback Calculated Property
Δfus 58.18 kJ/mol Joback Calculated Property
Δvap 94.12 kJ/mol Joback Calculated Property
log10WS [-6.78; -6.78]   Show Hide
log10WS -6.78 Aq. Sol...
log10WS -6.78 Estimat...
logPoct/wat 5.341 Crippen Calculated Property
McVol 252.920 ml/mol McGowan Calculated Property
Pc 1821.61 kPa Joback Calculated Property
Tboil 991.14 K Joback Calculated Property
Tc 1236.56 K Joback Calculated Property
Tfus 739.91 K Joback Calculated Property
Vc 1.008 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [759.01; 804.91] J/mol×K [991.14; 1236.56] Show Hide
Cp,gas 759.01 J/mol×K 991.14 Joback Calculated Property
Cp,gas 768.07 J/mol×K 1032.04 Joback Calculated Property
Cp,gas 776.41 J/mol×K 1072.95 Joback Calculated Property
Cp,gas 784.15 J/mol×K 1113.85 Joback Calculated Property
Cp,gas 791.40 J/mol×K 1154.75 Joback Calculated Property
Cp,gas 798.28 J/mol×K 1195.66 Joback Calculated Property
Cp,gas 804.91 J/mol×K 1236.56 Joback Calculated Property

Similar Compounds

Oxycodone TMS derivative. Quinine, trimethylsilyl ether. Benazepril Me. 9H-purine-6(1h)-thione, 9-beta-d-ribofuranosyl-, 2',3'-diacetate, 5'-bis(3,5-dimethylphenyl)phosphate. Bicyclohexyl-1,1'-diol, , 2-(N,N-dimethylaminomethyl)-ferroceneboronate. Naloxone, bis(trimethylsilyl) ether. Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5«alpha»)-. Oxymorphone. inosine-5'-monophosphate, TMS. xanthosine-5'-monophosphate, TMS. Moexipril desethyl 3Me (Moexprilate 3Me). Oxycodone. Moexipril Me. Oxymorphone, bis(trimethylsilyl) ether. Naloxone.

Find more compounds similar to Benzenemethanamine, 2-chloro-N-(2,6-dinitro-4-(trifluoromethyl)phenyl)-N-ethyl-6-fluoro-.

Sources

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