Chemical Properties of 2-Chloro-5-nitrobenzyl alcohol, 1-methylpropyl ether

2-Chloro-5-nitrobenzyl alcohol, 1-methylpropyl ether

InChI
InChI=1S/C11H14ClNO3/c1-3-8(2)16-7-9-6-10(13(14)15)4-5-11(9)12/h4-6,8H,3,7H2,1-2H3
InChI Key
UZAHJQABPLMASO-UHFFFAOYSA-N
Formula
C11H14ClNO3
SMILES
CCC(C)OCc1cc([N+](=O)[O-])ccc1Cl
Molecular Weight1
243.69
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Physical Properties

Property Value Unit Source
ΔfusH° 30.73 kJ/mol Joback Calculated Property
ΔvapH° 80.10 kJ/mol Relay (1.0) Calculated Property
log10WS -3.41 Relay (1.0) Calculated Property
logPoct/wat 3.563 Crippen Calculated Property
McVol 177.620 ml/mol McGowan Calculated Property
Inp [1777.00; 1777.00]   Show Hide
Inp 1777.00 NIST
Inp 1777.00 NIST
Tboil 578.26 K Relay (1.0) Calculated Property
Tfus 291.33 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 [456.25; 522.73] J/mol×K [699.17; 934.26] Show Hide
Cp,gas 456.25 J/mol×K 699.17 Joback Calculated Property
Cp,gas 469.63 J/mol×K 738.35 Joback Calculated Property
Cp,gas 482.05 J/mol×K 777.53 Joback Calculated Property
Cp,gas 493.55 J/mol×K 816.71 Joback Calculated Property
Cp,gas 504.15 J/mol×K 855.89 Joback Calculated Property
Cp,gas 513.87 J/mol×K 895.07 Joback Calculated Property
Cp,gas 522.73 J/mol×K 934.26 Joback Calculated Property

Similar Compounds

2-Chloro-5-nitrobenzyl alcohol, n-butyl ether. 2-Chloro-5-nitrobenzyl alcohol, n-propyl ether. 2-Chloro-5-nitrobenzyl alcohol, isopropyl ether. 2-Chloro-5-nitrobenzyl alcohol, n-pentyl ether. 2-Chloro-5-nitrobenzyl alcohol, 3-methylbutyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylpropyl ether. 2-Chloro-5-nitrobenzyl alcohol, 2-methylbutyl ether. 3-Nitrobenzyl alcohol, 1-methylpropyl ether. (3-Nitrophenyl) methanol, n-butyl ether. 2,4-Dichlorobenzyl alcohol, 1-methylpropyl ether. (3-Nitrophenyl) methanol, n-pentyl ether. 2,5-Dichlorobenzyl alcohol, 1-methylpropyl ether. Glutaric acid, 2-chloro-6-fluorophenyl 3-nitrobenzyl ester. (3-Nitrophenyl) methanol, 3-methylbutyl ether. Glutaric acid, 2,4,6-trichlorophenyl 3-nitrobenzyl ester.

Find more compounds similar to 2-Chloro-5-nitrobenzyl alcohol, 1-methylpropyl ether.

Sources

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