Chemical Properties of 2-Chloro-5-nitrobenzyl alcohol, isopropyl ether

2-Chloro-5-nitrobenzyl alcohol, isopropyl ether

InChI
InChI=1S/C10H12ClNO3/c1-7(2)15-6-8-5-9(12(13)14)3-4-10(8)11/h3-5,7H,6H2,1-2H3
InChI Key
DTHLKNLMHFEKGM-UHFFFAOYSA-N
Formula
C10H12ClNO3
SMILES
CC(C)OCc1cc([N+](=O)[O-])ccc1Cl
Molecular Weight1
229.66
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Physical Properties

Property Value Unit Source
ΔfusH° 28.14 kJ/mol Joback Calculated Property
ΔvapH° 78.38 kJ/mol Relay (1.0) Calculated Property
log10WS -3.21 Relay (1.0) Calculated Property
logPoct/wat 3.173 Crippen Calculated Property
McVol 163.530 ml/mol McGowan Calculated Property
Inp [1677.00; 1677.00]   Show Hide
Inp 1677.00 NIST
Inp 1677.00 NIST
Tboil 564.24 K Relay (1.0) Calculated Property
Tfus 310.77 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [405.85; 469.14] J/mol×K [676.29; 916.23] Show Hide
Cp,gas 405.85 J/mol×K 676.29 Joback Calculated Property
Cp,gas 418.61 J/mol×K 716.28 Joback Calculated Property
Cp,gas 430.46 J/mol×K 756.27 Joback Calculated Property
Cp,gas 441.41 J/mol×K 796.26 Joback Calculated Property
Cp,gas 451.49 J/mol×K 836.25 Joback Calculated Property
Cp,gas 460.73 J/mol×K 876.24 Joback Calculated Property
Cp,gas 469.14 J/mol×K 916.23 Joback Calculated Property

Similar Compounds

2-Chloro-5-nitrobenzyl alcohol, n-propyl ether. 2-Chloro-5-nitrobenzyl alcohol, 1-methylpropyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylpropyl ether. 2-Chloro-5-nitrobenzyl alcohol, n-butyl ether. Formic acid, (2-chloro-5-nitrophenyl)methyl ester. 2-Chloro-5-nitrobenzyl alcohol, n-pentyl ether. Acetic acid, (2-chloro-5-nitrophenyl)methyl ester. 2-Chloro-5-nitrobenzyl alcohol, 3-methylbutyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylbutyl ether. (3-Nitrophenyl) methanol, isopropyl ether. 2-Chloro-5-nitrobenzyl alcohol, chlorodifluoroacetate. 3-Nitrobenzyl alcohol, 1-methylpropyl ether. Benzoic acid, (2-chloro-5-nitrophenyl)methyl ester. (3-Nitrophenyl) methanol, n-propyl ether. (3-Nitrophenyl) methanol, n-butyl ether.

Find more compounds similar to 2-Chloro-5-nitrobenzyl alcohol, isopropyl ether.

Sources

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