Chemical Properties of methyl (4-nitrophenyl)carbamate (CAS 1943-87-9)

methyl (4-nitrophenyl)carbamate

InChI
InChI=1S/C8H8N2O4/c1-14-8(11)9-6-2-4-7(5-3-6)10(12)13/h2-5H,1H3,(H,9,11)
InChI Key
DAWCBJXIGOELKF-UHFFFAOYSA-N
Formula
C8H8N2O4
SMILES
COC(=O)Nc1ccc([N+](=O)[O-])cc1
Molecular Weight1
196.16
CAS
1943-87-9
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Physical Properties

Property Value Unit Source
ΔcH°solid -3863.50 ± 4.60 kJ/mol NIST
ΔfH°gas -289.15 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid -427.90 ± 4.60 kJ/mol NIST
ΔfusH° 30.96 kJ/mol Joback Calculated Property
ΔvapH° 95.63 kJ/mol Relay (1.0) Calculated Property
IE 9.00 eV Relay (1.0) Calculated Property
log10WS -2.89 Relay (1.0) Calculated Property
logPoct/wat 1.773 Crippen Calculated Property
McVol 134.660 ml/mol McGowan Calculated Property
Tboil 565.44 K Relay (1.0) Calculated Property
Tfus 395.58 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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 [341.14; 391.54] J/mol×K [674.53; 917.50] Show Hide
Cp,gas 341.14 J/mol×K 674.53 Joback Calculated Property
Cp,gas 351.79 J/mol×K 715.03 Joback Calculated Property
Cp,gas 361.51 J/mol×K 755.52 Joback Calculated Property
Cp,gas 370.32 J/mol×K 796.02 Joback Calculated Property
Cp,gas 378.25 J/mol×K 836.51 Joback Calculated Property
Cp,gas 385.31 J/mol×K 877.01 Joback Calculated Property
Cp,gas 391.54 J/mol×K 917.50 Joback Calculated Property

Similar Compounds

Carbamic acid, (4-nitrophenyl)-, ethyl ester. Carbamic acid, phenyl-, methyl ester. AMINOFORMIC ACID, N-[3-NITROPHENYL]-, ETHYL(ESTER). P-phenylazo carbanilic acid, methyl ester. Carbamic acid, (2-nitrophenyl)-, methyl ester. Carbamic acid, (4-chlorophenyl)-, methyl ester. Acetamide, N-(4-nitrophenyl)-. P-nitro carbanilic acid, n-butyl ester. Carbamic acid, phenyl-, ethyl ester. N-(4-Nitrophenyl)-N'-phenyl-urea. Carbamic acid, 4-bromophenyl-, ethyl ester. Carbamic acid, 4-methylphenyl, methyl ester. Carbamic acid, (2-nitrophenyl)-, ethyl ester. Benzenamine, N-methyl-4-nitro-. m-Nitro carbanilic acid, n-propyl ester.

Find more compounds similar to methyl (4-nitrophenyl)carbamate.

Sources

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