Chemical Properties of 2,6-Difluoro-3-methylbenzoic acid, 2-nitro-5-fluorophenyl ester

2,6-Difluoro-3-methylbenzoic acid, 2-nitro-5-fluorophenyl ester

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InChI
InChI=1S/C14H8F3NO4/c1-7-2-4-9(16)12(13(7)17)14(19)22-11-6-8(15)3-5-10(11)18(20)21/h2-6H,1H3
InChI Key
QCJJZJLJSOZVNE-UHFFFAOYSA-N
Formula
C14H8F3NO4
SMILES
Cc1ccc(F)c(C(=O)Oc2cc(F)ccc2[N+](=O)[O-])c1F
Molecular Weight1
311.21
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Physical Properties

Property Value Unit Source
Δf -539.13 kJ/mol Joback Calculated Property
Δfgas -760.47 kJ/mol Joback Calculated Property
Δfus 41.54 kJ/mol Joback Calculated Property
Δvap 77.92 kJ/mol Joback Calculated Property
log10WS -5.68 Crippen Calculated Property
logPoct/wat 3.540 Crippen Calculated Property
McVol 190.770 ml/mol McGowan Calculated Property
Pc 2374.90 kPa Joback Calculated Property
Inp [2109.00; 2109.00]   Show Hide
Inp 2109.00 NIST
Inp 2109.00 NIST
Tboil 823.92 K Joback Calculated Property
Tc 1058.23 K Joback Calculated Property
Tfus 580.52 K Joback Calculated Property
Vc 0.763 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [526.53; 572.64] J/mol×K [823.92; 1058.23] Show Hide
Cp,gas 526.53 J/mol×K 823.92 Joback Calculated Property
Cp,gas 536.60 J/mol×K 862.97 Joback Calculated Property
Cp,gas 545.69 J/mol×K 902.02 Joback Calculated Property
Cp,gas 553.82 J/mol×K 941.07 Joback Calculated Property
Cp,gas 561.01 J/mol×K 980.12 Joback Calculated Property
Cp,gas 567.27 J/mol×K 1019.18 Joback Calculated Property
Cp,gas 572.64 J/mol×K 1058.23 Joback Calculated Property

Similar Compounds

2,6-Difluoro-3-methylbenzoic acid, 4-nitrophenyl ester. 2-Fluoro-3-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. 2,5-Difluorobenzoic acid, 2-nitro-5-fluorophenyl ester. 2,4-Difluorobenzoic acid, 2-nitro-5-fluorophenyl ester. 2,6-Difluoro-3-methylbenzoic acid, 3-fluorophenyl ester. p-Toluic acid, 5-fluoro-2-nitrophenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. Isophthalic acid, 2-nitro-5-fluorophenyl propyl ester. Isophthalic acid, ethyl 2-nitro-5-fluorophenyl ester. Isophthalic acid, butyl 2-nitro-5-fluorophenyl ester. Isophthalic acid, 2-nitro-5-fluorophenyl pentyl ester. Isophthalic acid, isobutyl 2-nitro-5-fluorophenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-nitro-5-fluorophenyl ester. Isophthalic acid, hexyl 2-nitro-5-fluorophenyl ester. 3-Chloro-2-fluorobenzoic acid, 2-nitro-5-fluorophenyl ester.

Find more compounds similar to 2,6-Difluoro-3-methylbenzoic acid, 2-nitro-5-fluorophenyl ester.

Sources

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