Chemical Properties of 6-tert-Butyl-2,4-dimethylphenol (CAS 1879-09-0)

6-tert-Butyl-2,4-dimethylphenol

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InChI
InChI=1S/C12H18O/c1-8-6-9(2)11(13)10(7-8)12(3,4)5/h6-7,13H,1-5H3
InChI Key
OPLCSTZDXXUYDU-UHFFFAOYSA-N
Formula
C12H18O
SMILES
Cc1cc(C)c(O)c(C(C)(C)C)c1
Molecular Weight1
178.27
CAS
1879-09-0
Other Names
  • 2,4-Dimethyl-6-tert-butylphenol
  • 2,4-Xylenol, 6-tert-butyl-
  • 2-Methyl-6-tert-butyl-p-cresol
  • 2-tert-Butyl-4,6-dimethylphenol
  • 6-t-Butyl-2,4-dimethylphenol
  • 6-t-Butyl-2,4-xylenol
  • 6-tert-Butyl-2,4-xylenol
  • NSC 8130
  • Phenol, 2-(1,1-dimethylethyl)-4,6-dimethyl-
  • Prodox 340
  • Topanol A
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Physical Properties

Property Value Unit Source
Δf -8.47 kJ/mol Joback Calculated Property
Δfgas -263.48 kJ/mol Joback Calculated Property
Δfus 18.47 kJ/mol Joback Calculated Property
Δvap 68.40 ± 0.80 kJ/mol NIST
log10WS -3.28 Crippen Calculated Property
logPoct/wat 3.307 Crippen Calculated Property
McVol 162.050 ml/mol McGowan Calculated Property
Pc 2767.17 kPa Joback Calculated Property
Inp 1363.90 NIST
Tboil 587.99 K Joback Calculated Property
Tc 814.25 K Joback Calculated Property
Tfus 390.60 K Joback Calculated Property
Vc 0.554 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [407.95; 487.78] J/mol×K [587.99; 814.25] Show Hide
Cp,gas 407.95 J/mol×K 587.99 Joback Calculated Property
Cp,gas 423.54 J/mol×K 625.70 Joback Calculated Property
Cp,gas 438.08 J/mol×K 663.41 Joback Calculated Property
Cp,gas 451.67 J/mol×K 701.12 Joback Calculated Property
Cp,gas 464.42 J/mol×K 738.83 Joback Calculated Property
Cp,gas 476.42 J/mol×K 776.54 Joback Calculated Property
Cp,gas 487.78 J/mol×K 814.25 Joback Calculated Property
η [0.0000316; 0.0010949] Pa×s [390.60; 587.99] Show Hide
η 0.0010949 Pa×s 390.60 Joback Calculated Property
η 0.0004821 Pa×s 423.50 Joback Calculated Property
η 0.0002389 Pa×s 456.40 Joback Calculated Property
η 0.0001301 Pa×s 489.30 Joback Calculated Property
η 0.0000765 Pa×s 522.19 Joback Calculated Property
η 0.0000479 Pa×s 555.09 Joback Calculated Property
η 0.0000316 Pa×s 587.99 Joback Calculated Property
ΔvapH [45.40; 67.20] kJ/mol [318.50; 455.00] Show Hide
ΔvapH 67.20 ± 0.80 kJ/mol 318.50 NIST
ΔvapH 54.40 kJ/mol 439.50 NIST
ΔvapH 52.70 kJ/mol 439.50 NIST
ΔvapH 51.70 kJ/mol 439.50 NIST
ΔvapH 49.70 kJ/mol 439.50 NIST
ΔvapH 45.40 kJ/mol 439.50 NIST
ΔvapH 58.40 kJ/mol 455.00 NIST

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.67] kPa [397.72; 535.56] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.66619e+01
Coefficient B-5.09917e+03
Coefficient C-8.63080e+01
Temperature range, min.397.72
Temperature range, max.535.56
Pvap 1.33 kPa 397.72 Calculated Property
Pvap 2.87 kPa 413.04 Calculated Property
Pvap 5.78 kPa 428.35 Calculated Property
Pvap 10.95 kPa 443.67 Calculated Property
Pvap 19.67 kPa 458.98 Calculated Property
Pvap 33.76 kPa 474.30 Calculated Property
Pvap 55.62 kPa 489.61 Calculated Property
Pvap 88.33 kPa 504.93 Calculated Property
Pvap 135.77 kPa 520.24 Calculated Property
Pvap 202.67 kPa 535.56 Calculated Property

Similar Compounds

Phenol, 4,6-di(1,1-dimethylethyl)-2-methyl-. Butylated Hydroxytoluene. 4,4'-Methylenebis(6-tert-butyl-o-cresol). Phenol, 2,6-bis(1,1-dimethylethyl)-4-ethyl-. Phenol, 2-(1,1-dimethylethyl)-6-methyl-. 4-methyl-2-tert-butyl-6-hydroxym ethyl-phenol. Phenol, 2-(1,1-dimethylethyl)-4-methyl-. 3,5-di-tert-Butyl-4-hydroxybenzyl alcohol. 2,2'-Ethylenebis(4-methyl-6-t-butylphenol). 4-methyl-2-tert-butyl-6-hydroperoxymethyl-phenol. 2,4-tert-butyl-6-hydroxym ethyl-phenol. Benzaldehyde, 2-hydroxy, 3,5-di(t-butyl). Phenol, 2,4,6-tri-tert-butyl-. 3,5-di-tert-Butyl-4-hydroxybenzaldehyde. Phenol, 4,4'-methylenebis[2,6-bis(1,1-dimethylethyl)-.

Find more compounds similar to 6-tert-Butyl-2,4-dimethylphenol.

Sources

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