Chemical Properties of Benzoic acid, 4-chloro-3-nitro- (CAS 96-99-1)

Benzoic acid, 4-chloro-3-nitro-

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InChI
InChI=1S/C7H4ClNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)
InChI Key
DFXQXFGFOLXAPO-UHFFFAOYSA-N
Formula
C7H4ClNO4
SMILES
O=C(O)c1ccc(Cl)c([N+](=O)[O-])c1
Molecular Weight1
201.56
CAS
96-99-1
Other Names
  • 3-Nitro-4-chlorobenzoic acid
  • 4-Chloro-3-nitrobenzoic acid
  • Kyselina 4-chloro-3-nitrobenzoova
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Physical Properties

Property Value Unit Source
Δf -140.91 kJ/mol Joback Calculated Property
Δfgas -265.53 kJ/mol Joback Calculated Property
Δfus 28.39 kJ/mol Joback Calculated Property
Δvap 79.18 kJ/mol Joback Calculated Property
log10WS -2.67 Aq. Sol...
logPoct/wat 1.946 Crippen Calculated Property
McVol 122.830 ml/mol McGowan Calculated Property
Pc 4697.74 kPa Joback Calculated Property
Tboil 731.52 K Joback Calculated Property
Tc 968.96 K Joback Calculated Property
Tfus [455.68; 456.30] K Show Hide
Tfus 455.68 K Aq. Sol...
Tfus 456.30 K Abraham...
Vc 0.475 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [283.94; 315.25] J/mol×K [731.52; 968.96] Show Hide
Cp,gas 283.94 J/mol×K 731.52 Joback Calculated Property
Cp,gas 290.51 J/mol×K 771.09 Joback Calculated Property
Cp,gas 296.51 J/mol×K 810.67 Joback Calculated Property
Cp,gas 301.95 J/mol×K 850.24 Joback Calculated Property
Cp,gas 306.87 J/mol×K 889.81 Joback Calculated Property
Cp,gas 311.30 J/mol×K 929.39 Joback Calculated Property
Cp,gas 315.25 J/mol×K 968.96 Joback Calculated Property

Similar Compounds

4-Chloro-3-nitrobenzaldehyde. 4-Chloro-3-nitrobenzoyl chloride. Benzoic acid, 3-nitro-. 2-Chloro-5-nitrobenzoic acid. 3-Amino-4-chlorobenzoic acid. 4-Chloro-3-nitrobenzophenone. Benzoic acid, 3-chloro-4-nitro-. 4-Chloro-2-nitrobenzoic acid. Benzoic acid, 4-methyl-3-nitro-. 4-Fluoro-3-nitrobenzoic acid. 2-Chloro-3,5-dinitrobenzoic acid. Benzoic acid, (4-chloro-3-nitrophenyl)methyl ester. 4-bromo-3-nitrobenzoic acid. Benzene, 1-chloro-4-methyl-2-nitro-. 3,4-dinitrobenzoic acid.

Find more compounds similar to Benzoic acid, 4-chloro-3-nitro-.

Mixtures

Sources

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