Chemical Properties of 1-Propen-2-ol, 1,1-bis(2,4,6-trimethylphenyl)- (CAS 89959-15-9)

1-Propen-2-ol, 1,1-bis(2,4,6-trimethylphenyl)-

InChI
InChI=1S/C21H26O/c1-12-8-14(3)19(15(4)9-12)21(18(7)22)20-16(5)10-13(2)11-17(20)6/h8-11,22H,1-7H3
InChI Key
UIXTVSOEEDOJBG-UHFFFAOYSA-N
Formula
C21H26O
SMILES
CC(O)=C(c1c(C)cc(C)cc1C)c1c(C)cc(C)cc1C
Molecular Weight1
294.43
CAS
89959-15-9
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Physical Properties

Property Value Unit Source
ω 0.8328 Relay (1.0) Calculated Property
ΔfG° 219.28 kJ/mol Joback Calculated Property
ΔfH°gas -165.99 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 37.56 kJ/mol Joback Calculated Property
ΔvapH° 105.85 kJ/mol Relay (1.0) Calculated Property
IE 7.50 ± 0.05 eV NIST
log10WS -5.35 Relay (1.0) Calculated Property
logPoct/wat 5.874 Crippen Calculated Property
McVol 260.800 ml/mol McGowan Calculated Property
Pc 1589.81 kPa Joback Calculated Property
Tboil 632.03 K Relay (1.0) Calculated Property
Tc 927.81 K Relay (1.0) Calculated Property
Tfus 396.19 K Relay (1.0) Calculated Property
Vc 0.934 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [350.57; 834.99] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.49000e+00
Coefficient B1.53794e+00
Coefficient C-8.97560e-04
Coefficient D2.01100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 350.57 J/mol×K 273.00 Calculated Property
Cp,gas 434.17 J/mol×K 353.78 Calculated Property
Cp,gas 508.84 J/mol×K 434.56 Calculated Property
Cp,gas 575.22 J/mol×K 515.33 Calculated Property
Cp,gas 633.95 J/mol×K 596.11 Calculated Property
Cp,gas 685.65 J/mol×K 676.89 Calculated Property
Cp,gas 730.97 J/mol×K 757.67 Calculated Property
Cp,gas 770.54 J/mol×K 838.44 Calculated Property
Cp,gas 805.01 J/mol×K 919.22 Calculated Property
Cp,gas 834.99 J/mol×K 1000.00 Calculated Property

Similar Compounds

Ethenol, 2,2-bis(2,4,6-trimethylphenyl)-. Nortriptyline M(di-HO). Naphthalene, 1,2-dihydro-4-phenyl-. Nortriptyline M(HO). Naphthalene, 1,2-dihydro-6-methyl-. Amitriptyline M(HO). Amitriptyline. Nortriptyline. Dimesitylmethane. Hydroxynortriptyline. Acetamide, N-[3-(10,11-dihydro-5H-dibenzo[a,d]cyclohepten-5-ylidene)propyl]-2,2,2-trifluoro-N-methyl-. N-Acetylnortriptyline. Desmethyldoxepin. Amitriptyline M (HO-N-oxide). Hydroxyamitryptyline.

Find more compounds similar to 1-Propen-2-ol, 1,1-bis(2,4,6-trimethylphenyl)-.

Sources

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