Chemical Properties of Benfluralin (CAS 1861-40-1)

Benfluralin

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InChI
InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3
InChI Key
SMDHCQAYESWHAE-UHFFFAOYSA-N
Formula
C13H16F3N3O4
SMILES
CCCCN(CC)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]
Molecular Weight1
335.28
CAS
1861-40-1
Other Names
  • Balan
  • Balfin
  • Banafine
  • Benalan
  • Benefex
  • Benefin
  • Benephin
  • Benfluraline
  • Benzenamine, N-butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)-
  • Bethrodine
  • Binnell
  • Blulan
  • Bonalan
  • Carpidor
  • EL-110
  • Emblem
  • Flubalex
  • L 54521
  • N-Butyl-2,6-dinitro-N-ethyl-4-trifluoromethylaniline
  • N-Butyl-N-ethyl-2,6-dinitro-4-(trifluoromethyl)benzenamine
  • N-Butyl-N-ethyl-2,6-dinitro-4-trifluoromethylaniline
  • N-Butyl-N-ethyl-«alpha»,«alpha»,«alpha»-trifluoro-2,6-dinitro-p-toluidine
  • N-Butyl-N-ethyl-«alpha»,«alpha»,«alpha»-trifluoro-2,6-dinitro-p-toluidine
  • Quilan
  • p-Toluidine, N-butyl-N-ethyl-«alpha»,«alpha»,«alpha»-trifluoro-2,6-dinitro-
  • p-Toluidine, N-butyl-N-ethyl-«alpha»,«alpha»,«alpha»-trifluoro-2,6-dinitro-
  • «alpha»,«alpha»,«alpha»-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine
  • «alpha»,«alpha»,«alpha»-Trifluoro-2,6-dinitro-N,N-ethylbutyl-p-toluidine
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Physical Properties

Property Value Unit Source
Δf -257.61 kJ/mol Joback Calculated Property
Δfgas -660.60 kJ/mol Joback Calculated Property
Δfus 49.87 kJ/mol Joback Calculated Property
Δvap 80.27 kJ/mol Joback Calculated Property
log10WS [-5.53; -5.53]   Show Hide
log10WS -5.53 Aq. Sol...
log10WS -5.53 Estimat...
logPoct/wat 4.148 Crippen Calculated Property
McVol 220.400 ml/mol McGowan Calculated Property
Pc 1933.83 kPa Joback Calculated Property
Inp [1665.00; 1704.00]   Show Hide
Inp 1672.00 NIST
Inp Outlier 1704.00 NIST
Inp 1670.00 NIST
Inp 1672.00 NIST
Inp 1676.00 NIST
Inp 1679.00 NIST
Inp 1668.00 NIST
Inp 1670.00 NIST
Inp 1665.00 NIST
Tboil 849.16 K Joback Calculated Property
Tc 1073.60 K Joback Calculated Property
Tfus 338.72 ± 0.20 K NIST
Vc 0.880 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [673.72; 731.90] J/mol×K [849.16; 1073.60] Show Hide
Cp,gas 673.72 J/mol×K 849.16 Joback Calculated Property
Cp,gas 685.33 J/mol×K 886.57 Joback Calculated Property
Cp,gas 696.07 J/mol×K 923.97 Joback Calculated Property
Cp,gas 706.01 J/mol×K 961.38 Joback Calculated Property
Cp,gas 715.24 J/mol×K 998.78 Joback Calculated Property
Cp,gas 723.85 J/mol×K 1036.19 Joback Calculated Property
Cp,gas 731.90 J/mol×K 1073.60 Joback Calculated Property
ΔfusH 36.50 kJ/mol 338.50 NIST

Similar Compounds

Profluralin. Trifluralin. Fluchloralin. 1-(2,4,6-Trinitrophenyl)piperidine. 1,3-Benzenediamine, 2,4-dinitro-N3,N3-dipropyl-6-(trifluoromethyl)-. Piperidine, 1-(2,4-dinitrophenyl)-. Isopropalin. Piperidine, 1-(2,4-dinitrophenyl)-4-propyl-. Ethalfluralin. Piperidine, 1-(5-chloro-2-nitrophenyl). Oryzalin. Nitralin. N-[4-Chloro-2-nitrophenyl]pyrrolidine. N-[2-Amino-4-(trifluoromethyl)phenyl]pyrrolidine. Pyrrolidine, 1-(5-chloro-2-nitrophenyl).

Find more compounds similar to Benfluralin.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.