Chemical Properties of 4-Hydroxy-3-nitrophenylacetic acid (CAS 10463-20-4)

4-Hydroxy-3-nitrophenylacetic acid

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InChI
InChI=1S/C8H7NO5/c10-7-2-1-5(4-8(11)12)3-6(7)9(13)14/h1-3,10H,4H2,(H,11,12)
InChI Key
QBHBHOSRLDPIHG-UHFFFAOYSA-N
Formula
C8H7NO5
SMILES
O=C(O)Cc1ccc(O)c([N+](=O)[O-])c1
Molecular Weight1
197.14
CAS
10463-20-4
Other Names
  • 3-Nitro-4-hydroxy phenylacetic acid
  • Benzeneacetic acid, 4-hydroxy-3-nitro-
Sources

Physical Properties

Property Value Unit Source
Δf -265.55 kJ/mol Joback Calculated Property
Δfgas -436.27 kJ/mol Joback Calculated Property
Δfus 32.96 kJ/mol Joback Calculated Property
Δvap 89.37 kJ/mol Joback Calculated Property
logPoct/wat 0.93 Crippen Calculated Property
Pc 5454.60 kPa Joback Calculated Property
Tboil 792.61 K Joback Calculated Property
Tc 1029.34 K Joback Calculated Property
Tfus 584.94 K Joback Calculated Property
Vc 0.45 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 352.02 J/mol×K 792.61 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Phenol, 4-(1-methylethyl)-2-nitro. 4-Tert-butyl-2-nitrophenol. Phenol, 4-(1-methylpropyl)-2-nitro. 4-Ethyl-2,6-dinitrophenol. Phenol, 4-(1-ethylpropyl)-2-nitro. Ethanone, 1-(4-hydroxy-3-nitrophenyl)-. Acetic acid, m-nitrophenyl-. Phenol, 4-(1,1-dimethylpropyl)-2-nitro. Phenol, 4-(1-methylbutyl)-2-nitro. Phenol, 4-methyl-2-nitro-. Phenol, 4-(1-methylpentyl)-2-nitro. Phenol, 4-(1-ethylbutyl)-2-nitro. Methyl (3-nitrophenyl)acetate. 4-Hydroxy-3-nitrobenzyl alcohol. 4'-Methoxy-3'-nitroacetophenone.

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