Chemical Properties of 2-Chloro-3,5-dinitrobenzoic acid (CAS 2497-91-8)

2-Chloro-3,5-dinitrobenzoic acid

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InChI
InChI=1S/C7H3ClN2O6/c8-6-4(7(11)12)1-3(9(13)14)2-5(6)10(15)16/h1-2H,(H,11,12)
InChI Key
ADTKEYLCJYYHHH-UHFFFAOYSA-N
Formula
C7H3ClN2O6
SMILES
O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Cl
Molecular Weight1
246.56
CAS
2497-91-8
Other Names
  • Benzoic acid, 2-chloro-3,5-dinitro-
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Physical Properties

Property Value Unit Source
Δf -114.99 kJ/mol Joback Calculated Property
Δfgas -287.76 kJ/mol Joback Calculated Property
Δfus 39.37 kJ/mol Joback Calculated Property
Δvap 96.43 kJ/mol Joback Calculated Property
log10WS -3.52 Crippen Calculated Property
logPoct/wat 1.855 Crippen Calculated Property
McVol 140.250 ml/mol McGowan Calculated Property
Pc 4678.49 kPa Joback Calculated Property
Tboil 513.70 K NIST
Tc 1142.93 K Joback Calculated Property
Tfus 660.52 K Joback Calculated Property
Vc 0.557 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [349.36; 370.74] J/mol×K [888.34; 1142.93] Show Hide
Cp,gas 349.36 J/mol×K 888.34 Joback Calculated Property
Cp,gas 354.38 J/mol×K 930.77 Joback Calculated Property
Cp,gas 358.77 J/mol×K 973.20 Joback Calculated Property
Cp,gas 362.57 J/mol×K 1015.64 Joback Calculated Property
Cp,gas 365.81 J/mol×K 1058.07 Joback Calculated Property
Cp,gas 368.52 J/mol×K 1100.50 Joback Calculated Property
Cp,gas 370.74 J/mol×K 1142.93 Joback Calculated Property

Similar Compounds

2-Chloro-5-nitrobenzoic acid. Benzoic acid, 3,5-dinitro-. Benzoic acid, 4-chloro-3-nitro-. 2-methyl-3,5-dinitrobenzoic acid. 3-Amino-5-nitrobenzoic acid. Benzoic acid, 2-hydroxy-3,5-dinitro-. Methyl 3,5-dinitrobenzoate. Neopentyl 3,5-dinitrobenzoate. 2-Chloroethyl 3,5-dinitrobenzoate. Benzoic acid, 3,5-dinitro-, phenylmethyl ester. Benzoic acid, (4-chloro-3-nitrophenyl)methyl ester. Benzoic acid, 3,5-dinitro, allyl ester. Benzoic acid, 3,5-dinitro-,silver salt. Ethyl 3,5-dinitrobenzoate. 2,2,2-Trichloroethyl 3,5-dinitrobenzoate.

Find more compounds similar to 2-Chloro-3,5-dinitrobenzoic acid.

Sources

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