Chemical Properties of 3-Methyl-2,4,6-trinitro-phenol (CAS 602-99-3)

3-Methyl-2,4,6-trinitro-phenol

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InChI
InChI=1S/C7H5N3O7/c1-3-4(8(12)13)2-5(9(14)15)7(11)6(3)10(16)17/h2,11H,1H3
InChI Key
YYGJRRYSYLLCQH-UHFFFAOYSA-N
Formula
C7H5N3O7
SMILES
Cc1c([N+](=O)[O-])cc([N+](=O)[O-])c(O)c1[N+](=O)[O-]
Molecular Weight1
243.13
CAS
602-99-3
Other Names
  • 2,4,6-Trinitro-m-cresol
  • Phenol, 3-methyl-2,4,6-trinitro-
  • m-Cresol, 2,4,6-trinitro-
  • Cresylite
  • Picric acid, methyl-
  • Picric acid, 3-methyl-
  • Trinitro-m-cresol
  • Trinitro-m-cresolic acid
  • 2,4,6-Trinitro-3-methylphenol
  • Trinitro-meta-cresol
  • UN 0216
  • 3-Methylpicric acid
  • Methylpicric acid
  • NSC 3182

Physical Properties

Property Value Unit Source
Δcsolid [-3213.90; -3212.70] kJ/mol Show Hide
Δcsolid -3212.70 ± 3.20 kJ/mol NIST
Δcsolid -3213.90 ± 3.20 kJ/mol NIST
Δf 43.61 kJ/mol Joback Calculated Property
Δfgas -195.28 kJ/mol Joback Calculated Property
Δfus 46.63 kJ/mol Joback Calculated Property
Δsub [104.60; 111.20] kJ/mol Show Hide
Δsub 111.20 ± 2.10 kJ/mol NIST
Δsub 104.60 kJ/mol NIST
Δvap 98.22 kJ/mol Joback Calculated Property
log10WS -3.45 Crippen Calculated Property
logPoct/wat 1.425 Crippen Calculated Property
McVol 143.860 ml/mol McGowan Calculated Property
Pc 4966.33 kPa Joback Calculated Property
Tboil 937.32 K Joback Calculated Property
Tc 1229.70 K Joback Calculated Property
Tfus 775.18 K Joback Calculated Property
Vc 0.531 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [404.16; 449.98] J/mol×K [937.32; 1229.70] Show Hide
Cp,gas 404.16 J/mol×K 937.32 Joback Calculated Property
Cp,gas 411.79 J/mol×K 986.05 Joback Calculated Property
Cp,gas 419.22 J/mol×K 1034.78 Joback Calculated Property
Cp,gas 426.61 J/mol×K 1083.51 Joback Calculated Property
Cp,gas 434.10 J/mol×K 1132.24 Joback Calculated Property
Cp,gas 441.84 J/mol×K 1180.97 Joback Calculated Property
Cp,gas 449.98 J/mol×K 1229.70 Joback Calculated Property
ΔsubH 103.30 kJ/mol 337.50 NIST

Similar Compounds

2-Isopropyl-4,6-dinitro-5-methyl phenol. Phenol, 2-methyl-3,5-dinitro-. Musk ambrette (artificial). Phenol, 2-methyl, 4,6-dinitro-. 3-Methyl-2-nitrophenol. 3,5-Dinitrosalicylaldehyde. Trinitrotoluene. medinoterb acetate. Dinoterb. 2,4-Dinitro-1,3-dimethyl-benzene. Phenol, 2,4-dinitro-6-ethyl-. p-Toluidine, 3,5-dinitro-. Benzoic acid, 2-hydroxy-3,5-dinitro-. Phenol, 3-methyl-4-nitro-. 3,5-Dinitrosalicylic acid, monosodium salt.

Find more compounds similar to 3-Methyl-2,4,6-trinitro-phenol.

Sources

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