Chemical Properties of 4-(4-Nitrophenyl)butyric acid (CAS 5600-62-4)

4-(4-Nitrophenyl)butyric acid

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InChI
InChI=1S/C10H11NO4/c12-10(13)3-1-2-8-4-6-9(7-5-8)11(14)15/h4-7H,1-3H2,(H,12,13)
InChI Key
WQMLUHZFRFCQDB-UHFFFAOYSA-N
Formula
C10H11NO4
SMILES
O=C(O)CCCc1ccc([N+](=O)[O-])cc1
Molecular Weight1
209.20
CAS
5600-62-4
Other Names
  • 4-(p-Nitrophenyl)butyric acid
  • Benzenebutanoic acid, 4-nitro-
  • «gamma»-(p-Nitrophenyl)butyric acid
Sources

Physical Properties

Property Value Unit Source
Δf -94.09 kJ/mol Joback Calculated Property
Δfgas -300.24 kJ/mol Joback Calculated Property
Δfus 32.36 kJ/mol Joback Calculated Property
Δvap 80.81 kJ/mol Joback Calculated Property
logPoct/wat 2.002 Crippen Calculated Property
Pc 3480.65 kPa Joback Calculated Property
Tboil 757.75 K Joback Calculated Property
Tc 979.90 K Joback Calculated Property
Tfus 495.76 K Joback Calculated Property
Vc 0.595 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 416.30 J/mol×K 757.75 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 4
-NO2 1
=C< (ring) 2
-CH2- 3
>C=O (nonring) 1
-OH (alcohol) 1

Similar Compounds

Benzenebutanoic acid, 4-nitro-, methyl ester. p-Nitrobutylbenzene. 1-Nitro-4-propylbenzene. 4-Nitrophenylacetone. 1-(4-Nitrophenyl)-1-butanone. p-t-amyl-nitrobenzene radical. Benzene, 1-ethyl-4-nitro-. Benzeneethanol, 4-nitro-. Benzene, 1-(1-methylethyl)-4-nitro-. Benzeneacetonitrile, 4-nitro-. 1-Bromo-2-(4-nitrophenyl)ethane. 4-(4-Aminophenyl)butanoic acid methyl ester. Hydrocinnamic acid, .beta.-methyl-p-nitro-, methyl ester. 1-tert-Butyl-4-nitrobenzene. 4,4'-Dinitrobibenzyl.

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