Chemical Properties of p-Nitrobenzoic acid, n-propyl ester (CAS 94-22-4)

p-Nitrobenzoic acid, n-propyl ester

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InChI
InChI=1S/C10H11NO4/c1-2-7-15-10(12)8-3-5-9(6-4-8)11(13)14/h3-6H,2,7H2,1H3
InChI Key
KXUOYHZSTGGNCK-UHFFFAOYSA-N
Formula
C10H11NO4
SMILES
CCCOC(=O)c1ccc([N+](=O)[O-])cc1
Molecular Weight1
209.20
CAS
94-22-4
Other Names
  • Benzoic acid, p-nitro-, propyl ester
  • Benzoic acid, 4-nitro-, propyl ester
  • Propyl 4-nitrobenzoate
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Physical Properties

Property Value Unit Source
Δf -62.27 kJ/mol Joback Calculated Property
Δfgas -280.23 kJ/mol Joback Calculated Property
Δfus 29.46 kJ/mol Joback Calculated Property
Δvap 66.54 kJ/mol Joback Calculated Property
log10WS -3.20 Crippen Calculated Property
logPoct/wat 2.162 Crippen Calculated Property
McVol 152.860 ml/mol McGowan Calculated Property
Pc 3072.75 kPa Joback Calculated Property
Inp [1594.00; 1636.00]   Show Hide
Inp 1600.00 NIST
Inp 1602.00 NIST
Inp 1612.00 NIST
Inp 1625.00 NIST
Inp 1636.00 NIST
Inp 1594.00 NIST
I [2367.00; 2426.00]   Show Hide
I 2376.00 NIST
I 2414.00 NIST
I 2426.00 NIST
I 2367.00 NIST
Tboil 687.99 K Joback Calculated Property
Tc 925.31 K Joback Calculated Property
Tfus 457.17 K Joback Calculated Property
Vc 0.594 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [395.14; 454.81] J/mol×K [687.99; 925.31] Show Hide
Cp,gas 395.14 J/mol×K 687.99 Joback Calculated Property
Cp,gas 407.29 J/mol×K 727.54 Joback Calculated Property
Cp,gas 418.53 J/mol×K 767.10 Joback Calculated Property
Cp,gas 428.88 J/mol×K 806.65 Joback Calculated Property
Cp,gas 438.36 J/mol×K 846.20 Joback Calculated Property
Cp,gas 446.99 J/mol×K 885.75 Joback Calculated Property
Cp,gas 454.81 J/mol×K 925.31 Joback Calculated Property

Similar Compounds

p-Nitrobenzoic acid, isobutyl ester. n-Butyl 4-nitrobenzoate. Benzoic acid, 4-nitro, 3-butenyl ester. Benzoic acid, 4-nitro-, ethyl ester. Benzoic acid, 4-nitro-, pentyl ester. 4-Nitrobenzoic acid, 2-butyl ester. 4-Nitrobenzoic acid, hexyl ester. Benzoic acid, 4-nitro, (Z)-3-hexenyl ester. Benzoic acid, 4-nitro, (E)-3-hexenyl ester. 4-Nitrobenzoic acid, decyl ester. Benzoic acid, 4-nitro-, octyl ester. 4-Nitrobenzoic acid, undecyl ester. 4-Nitrobenzoic acid, heptyl ester. 4-Nitrobenzoic acid, dodecyl ester. 4-Nitrobenzoic acid, nonyl ester.

Find more compounds similar to p-Nitrobenzoic acid, n-propyl ester.

Sources

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