Chemical Properties of 2,2'-Biphenol, 3,3',5,5'-tetrakis(1,1-dimethylethyl)- (CAS 6390-69-8)

2,2'-Biphenol, 3,3',5,5'-tetrakis(1,1-dimethylethyl)-

InChI
InChI=1S/C28H42O2/c1-25(2,3)17-13-19(23(29)21(15-17)27(7,8)9)20-14-18(26(4,5)6)16-22(24(20)30)28(10,11)12/h13-16,29-30H,1-12H3
InChI Key
GDGDLBOVIAWEAD-UHFFFAOYSA-N
Formula
C28H42O2
SMILES
CC(C)(C)c1cc(-c2cc(C(C)(C)C)cc(C(C)(C)C)c2O)c(O)c(C(C)(C)C)c1
Molecular Weight1
410.63
CAS
6390-69-8
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Physical Properties

Property Value Unit Source
ΔfH°gas -529.01 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 36.71 kJ/mol Joback Calculated Property
ΔvapH° 137.16 kJ/mol Relay (1.0) Calculated Property
IE 7.37 eV Relay (1.0) Calculated Property
logPoct/wat 7.955 Crippen Calculated Property
McVol 369.600 ml/mol McGowan Calculated Property
Tboil 634.70 K Relay (1.0) Calculated Property
Tfus 422.09 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1300.97; 1469.69] J/mol×K [1061.64; 1313.15] Show Hide
Cp,gas 1300.97 J/mol×K 1061.64 Joback Calculated Property
Cp,gas 1325.72 J/mol×K 1103.56 Joback Calculated Property
Cp,gas 1351.33 J/mol×K 1145.48 Joback Calculated Property
Cp,gas 1378.17 J/mol×K 1187.39 Joback Calculated Property
Cp,gas 1406.60 J/mol×K 1229.31 Joback Calculated Property
Cp,gas 1436.98 J/mol×K 1271.23 Joback Calculated Property
Cp,gas 1469.69 J/mol×K 1313.15 Joback Calculated Property
η [9.8227049e-09; 0.0000004] Pa×s [741.36; 1061.64] Show Hide
η 0.0000004 Pa×s 741.36 Joback Calculated Property
η 0.0000002 Pa×s 794.74 Joback Calculated Property
η 7.9097424e-08 Pa×s 848.12 Joback Calculated Property
η 4.2800391e-08 Pa×s 901.50 Joback Calculated Property
η 2.4805790e-08 Pa×s 954.88 Joback Calculated Property
η 1.5231479e-08 Pa×s 1008.26 Joback Calculated Property
η 9.8227049e-09 Pa×s 1061.64 Joback Calculated Property

Similar Compounds

[1,1'-Biphenyl]-2-ol, 3-(1,1-dimethylethyl)-. 2'-(Acetyloxy)-3,3',5,5'-tetratert-butyl[1,1'-biphenyl]-2-yl acetate. 3,3',5,5'-Tetratert-butyl-2'-(propionyloxy)[1,1'-biphenyl]-2-yl propionate. [1,1'-Biphenyl]-4-ol, 3,5-bis(1,1-dimethylethyl)-. [1,1'-Biphenyl]-2-ol, 5-(1,1-dimethylethyl)-. 5,8-Dihydro-5,8-ethano-2-phenyl-1,4-naphtho-hydroquinone. propyl-cannabinolic acid, TMS. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3-methoxy, diacetate. Tanshinone II-b. Apomorphine. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, diacetate. N-Methyl-2,3-dihydroxymorphinan. 2-(2-furyl)-3-hydroxypiperidine. 2-(5-methyl-2-furyl)-3-hydroxy-piperidine. (R)-1,2-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline.

Find more compounds similar to 2,2'-Biphenol, 3,3',5,5'-tetrakis(1,1-dimethylethyl)-.

Sources

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