Chemical Properties of 2-Isopropyl-4,6-dinitro-5-methyl phenol (CAS 303-21-9)

2-Isopropyl-4,6-dinitro-5-methyl phenol

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InChI
InChI=1S/C10H12N2O5/c1-5(2)7-4-8(11(14)15)6(3)9(10(7)13)12(16)17/h4-5,13H,1-3H3
InChI Key
XBCVBHKJVWVNID-UHFFFAOYSA-N
Formula
C10H12N2O5
SMILES
Cc1c([N+](=O)[O-])cc(C(C)C)c(O)c1[N+](=O)[O-]
Molecular Weight1
240.21
CAS
303-21-9
Other Names
  • 2,6-dinitrothymol
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Physical Properties

Property Value Unit Source
Δf 30.88 kJ/mol Joback Calculated Property
Δfgas -251.72 kJ/mol Joback Calculated Property
Δfus 39.51 kJ/mol Joback Calculated Property
Δvap 87.92 kJ/mol Joback Calculated Property
log10WS -3.98 Crippen Calculated Property
logPoct/wat 2.640 Crippen Calculated Property
McVol 168.710 ml/mol McGowan Calculated Property
Pc 3415.86 kPa Joback Calculated Property
Tboil 853.68 K Joback Calculated Property
Tc 1119.35 K Joback Calculated Property
Tfus 650.38 K Joback Calculated Property
Vc 0.612 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [489.27; 547.98] J/mol×K [853.68; 1119.35] Show Hide
Cp,gas 489.27 J/mol×K 853.68 Joback Calculated Property
Cp,gas 500.07 J/mol×K 897.96 Joback Calculated Property
Cp,gas 510.31 J/mol×K 942.24 Joback Calculated Property
Cp,gas 520.10 J/mol×K 986.51 Joback Calculated Property
Cp,gas 529.56 J/mol×K 1030.79 Joback Calculated Property
Cp,gas 538.81 J/mol×K 1075.07 Joback Calculated Property
Cp,gas 547.98 J/mol×K 1119.35 Joback Calculated Property

Similar Compounds

Musk ambrette (artificial). Dinoseb. medinoterb acetate. Anisole, 2-sec-butyl-4,6-dinitro-. Dinobuton. Phenol, 2,4-dinitro-6-ethyl-. Phenol, 2-cyclohexyl-4,6-dinitro-. Dinoseb acetate. Binapacryl. Nitrosothymol. Galathan, 1,2,3,12,15,16-hexadehydro-9,10-[methylenebis(oxy)]-. Phenol, 2-(1-methylethyl)-6-nitro. 2-Piperidinomethyl-8(ar)-methoxy-tetrahydro-1-acenaphthone. Nomifensine M(HO-methoxy), diacetylated. 4-Hydroxyoestrone (enol), TMS.

Find more compounds similar to 2-Isopropyl-4,6-dinitro-5-methyl phenol.

Sources

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