Chemical Properties of Ethyl 2-nitrobenzoate (CAS 610-34-4)

Ethyl 2-nitrobenzoate

InChI
InChI=1S/C9H9NO4/c1-2-14-9(11)7-5-3-4-6-8(7)10(12)13/h3-6H,2H2,1H3
InChI Key
CPNMAYYYYSWTIV-UHFFFAOYSA-N
Formula
C9H9NO4
SMILES
CCOC(=O)c1ccccc1[N+](=O)[O-]
Molecular Weight1
195.17
CAS
610-34-4
Other Names
  • Ethyl O-nitrobenzoate
  • Benzoic acid, 2-nitro-, ethyl ester
  • Benzoic acid, o-nitro-, ethyl ester
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Physical Properties

Property Value Unit Source
ω 0.6148 Relay (1.0) Calculated Property
ΔfG° -70.69 kJ/mol Joback Calculated Property
ΔfH°gas -308.93 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 26.87 kJ/mol Joback Calculated Property
ΔvapH° 77.76 kJ/mol Relay (1.0) Calculated Property
IE 9.70 eV Relay (1.0) Calculated Property
log10WS -3.20 Relay (1.0) Calculated Property
logPoct/wat 1.771 Crippen Calculated Property
McVol 138.770 ml/mol McGowan Calculated Property
Pc 3427.87 kPa Joback Calculated Property
Tboil 556.65 K Relay (1.0) Calculated Property
Tc 783.38 K Relay (1.0) Calculated Property
Tfus 286.22 K Relay (1.0) Calculated Property
Vc 0.498 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [345.96; 401.99] J/mol×K [665.11; 907.46] Show Hide
Cp,gas 345.96 J/mol×K 665.11 Joback Calculated Property
Cp,gas 357.42 J/mol×K 705.50 Joback Calculated Property
Cp,gas 367.99 J/mol×K 745.89 Joback Calculated Property
Cp,gas 377.72 J/mol×K 786.28 Joback Calculated Property
Cp,gas 386.61 J/mol×K 826.67 Joback Calculated Property
Cp,gas 394.70 J/mol×K 867.07 Joback Calculated Property
Cp,gas 401.99 J/mol×K 907.46 Joback Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 446.20 K 2.40 NIST

Similar Compounds

Benzoic acid, 2-nitro-, methyl ester. Terephthalic acid, ethyl 2-nitrobenzyl ester. Ethyl 3-nitrobenzoate. Benzoic acid, 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-, ethyl ester. Terephthalic acid, 2-nitrobenzyl propyl ester. 2-Ethoxycarbonylphenyl isothiocyanate. ethyl anthranilate. 2-Carboethoxyphenyl isocyanate. Bifenox. Benzoic acid, 2-nitro-. Acifluorfen, propyl ester. Terephthalic acid, butyl 2-nitrobenzyl ester. Benzoic acid, (5-chloro-2-nitrophenyl)methyl ester. Benzoic acid, 2-amino-, propyl ester. Methyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate.

Find more compounds similar to Ethyl 2-nitrobenzoate.

Sources

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