Chemical Properties of Benzoic acid, 3,5-dinitro- (CAS 99-34-3)

Benzoic acid, 3,5-dinitro-

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InChI
InChI=1S/C7H4N2O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)
InChI Key
VYWYYJYRVSBHJQ-UHFFFAOYSA-N
Formula
C7H4N2O6
SMILES
O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1
Molecular Weight1
212.12
CAS
99-34-3
Other Names
  • 2,4-dinitrobenzoic acid
  • 3,5-Dinitrobenzoic acid
  • 3-Carboxy-1,5-Dinitrobenzene
  • DNBA
  • Dinitrobenzoic acid
  • benzoic acid, 2,4-dinitro-
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Physical Properties

Property Value Unit Source
Δcsolid -2894.00 ± 0.40 kJ/mol NIST
Δf -93.43 kJ/mol Joback Calculated Property
Δfgas -260.55 kJ/mol Joback Calculated Property
Δfsolid -432.60 ± 0.40 kJ/mol NIST
Δfus 30.60 kJ/mol Vapor p...
Δvap 91.38 kJ/mol Joback Calculated Property
log10WS -2.42 Aq. Sol...
logPoct/wat 1.201 Crippen Calculated Property
McVol 128.010 ml/mol McGowan Calculated Property
Pc 5029.93 kPa Joback Calculated Property
Tboil 845.93 K Joback Calculated Property
Tc 1098.09 K Joback Calculated Property
Tfus 478.82 K Aq. Sol...
Vc 0.508 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [337.32; 363.88] J/mol×K [845.93; 1098.09] Show Hide
Cp,gas 337.32 J/mol×K 845.93 Joback Calculated Property
Cp,gas 343.27 J/mol×K 887.96 Joback Calculated Property
Cp,gas 348.56 J/mol×K 929.98 Joback Calculated Property
Cp,gas 353.23 J/mol×K 972.01 Joback Calculated Property
Cp,gas 357.31 J/mol×K 1014.04 Joback Calculated Property
Cp,gas 360.85 J/mol×K 1056.06 Joback Calculated Property
Cp,gas 363.88 J/mol×K 1098.09 Joback Calculated Property
ΔfusH 22.80 kJ/mol 480.40 NIST

Similar Compounds

Benzoic acid, 3,5-dinitro-,silver salt. 3-Amino-5-nitrobenzoic acid. Methyl 3,5-dinitrobenzoate. Benzoic acid, 3-nitro-. Prop-2-ynyl 3,5-dinitrobenzoate. Ethyl 3,5-dinitrobenzoate. 2,2,2-Trichloroethyl 3,5-dinitrobenzoate. 3-Iodo-5-nitrobenzoic acid. 2-Chloro-3,5-dinitrobenzoic acid. 3,4-dinitrobenzoic acid. Benzoic acid, 3,4-dinitro-. Benzoyl chloride, 3,5-dinitro-. Benzoic acid, 3,5-dinitro, isopropyl ester. 2,2-Dichloroethyl 3,5-dinitrobenzoate. 2-Chloroethyl 3,5-dinitrobenzoate.

Find more compounds similar to Benzoic acid, 3,5-dinitro-.

Mixtures

Sources

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