Chemical Properties of 3-Nitrobenzyl alcohol, trifluoroacetate

3-Nitrobenzyl alcohol, trifluoroacetate

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InChI
InChI=1S/C9H6F3NO4/c10-9(11,12)8(14)17-5-6-2-1-3-7(4-6)13(15)16/h1-4H,5H2
InChI Key
AUJHIPQYLBWCBG-UHFFFAOYSA-N
Formula
C9H6F3NO4
SMILES
O=C(OCc1cccc([N+](=O)[O-])c1)C(F)(F)F
Molecular Weight1
249.14
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Physical Properties

Property Value Unit Source
Δf -652.28 kJ/mol Joback Calculated Property
Δfgas -856.67 kJ/mol Joback Calculated Property
Δfus 28.69 kJ/mol Joback Calculated Property
Δvap 60.57 kJ/mol Joback Calculated Property
log10WS -3.36 Crippen Calculated Property
logPoct/wat 2.200 Crippen Calculated Property
McVol 144.080 ml/mol McGowan Calculated Property
Pc 3005.73 kPa Joback Calculated Property
Inp [1417.00; 1417.00]   Show Hide
Inp 1417.00 NIST
Inp 1417.00 NIST
Tboil 659.69 K Joback Calculated Property
Tc 882.80 K Joback Calculated Property
Tfus 450.09 K Joback Calculated Property
Vc 0.581 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [373.78; 422.51] J/mol×K [659.69; 882.80] Show Hide
Cp,gas 373.78 J/mol×K 659.69 Joback Calculated Property
Cp,gas 383.86 J/mol×K 696.88 Joback Calculated Property
Cp,gas 393.10 J/mol×K 734.06 Joback Calculated Property
Cp,gas 401.54 J/mol×K 771.25 Joback Calculated Property
Cp,gas 409.23 J/mol×K 808.43 Joback Calculated Property
Cp,gas 416.21 J/mol×K 845.62 Joback Calculated Property
Cp,gas 422.51 J/mol×K 882.80 Joback Calculated Property

Similar Compounds

3-Nitrobenzyl alcohol, pentafluoropropionate. (3-Nitrophenyl) methanol, ethyl ether. Ether, bis(m-nitrobenzyl)-. 3,5-Dinitrobenzyl alcohol, chlorodifluoroacetate. 3-Nitrobenzyl alcohol, heptafluorobutyrate. (3-Nitrophenyl) methanol, isopropyl ether. 4-Fluoro-3-nitrobenzyl alcohol, chlorodifluoroacetate. Succinic acid, di(3-nitrobenzyl) ester. 2-Chloro-5-nitrobenzyl alcohol, chlorodifluoroacetate. 4-Chloro-3-nitrobenzyl alcohol, chlorodifluoroacetate. (3-Nitrophenyl) methanol, n-propyl ether. Benzenemethanol, 3-nitro-. 2-Fluoro-5-nitrobenzyl alcohol, chlorodifluoroacetate. Succinic acid, ethyl 3-nitrobenzyl ester. Acetic acid, (2-chloro-5-nitrophenyl)methyl ester.

Find more compounds similar to 3-Nitrobenzyl alcohol, trifluoroacetate.

Sources

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