Chemical Properties of 1-(4-Methoxyphenyl)propane-1,2-diol (CAS 51410-48-1)

1-(4-Methoxyphenyl)propane-1,2-diol

InChI
InChI=1S/C10H14O3/c1-7(11)10(12)8-3-5-9(13-2)6-4-8/h3-7,10-12H,1-2H3
InChI Key
MRDZSBVJWOXBRW-UHFFFAOYSA-N
Formula
C10H14O3
SMILES
COc1ccc(C(O)C(C)O)cc1
Molecular Weight1
182.22
CAS
51410-48-1
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Physical Properties

Property Value Unit Source
ΔfH°gas -467.13 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.63 kJ/mol Joback Calculated Property
ΔvapH° 97.65 kJ/mol Relay (1.0) Calculated Property
IE 8.32 eV Relay (1.0) Calculated Property
log10WS -0.94 Relay (1.0) Calculated Property
logPoct/wat 1.109 Crippen Calculated Property
McVol 145.610 ml/mol McGowan Calculated Property
Inp [1582.30; 1582.30]   Show Hide
Inp 1582.30 NIST
Inp 1582.30 NIST
Tboil 575.85 K Relay (1.0) Calculated Property
Tc 777.68 K Relay (1.0) Calculated Property
Tfus 377.00 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [202.69; 470.59] 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 A6.91000e+00
Coefficient B8.32040e-01
Coefficient C-4.40560e-04
Coefficient D7.22000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 202.69 J/mol×K 273.00 Calculated Property
Cp,gas 249.32 J/mol×K 353.78 Calculated Property
Cp,gas 291.21 J/mol×K 434.56 Calculated Property
Cp,gas 328.57 J/mol×K 515.33 Calculated Property
Cp,gas 361.64 J/mol×K 596.11 Calculated Property
Cp,gas 390.65 J/mol×K 676.89 Calculated Property
Cp,gas 415.81 J/mol×K 757.67 Calculated Property
Cp,gas 437.38 J/mol×K 838.44 Calculated Property
Cp,gas 455.56 J/mol×K 919.22 Calculated Property
Cp,gas 470.59 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0079564; 0.0000302] Pa×s [355.27; 598.62] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.85448e+01
Coefficient B4.87111e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.355.27
Temperature range, max.598.62
η 0.0079564 Pa×s 355.27 Calculated Property
η 0.0030170 Pa×s 382.31 Calculated Property
η 0.0013004 Pa×s 409.35 Calculated Property
η 0.0006221 Pa×s 436.39 Calculated Property
η 0.0003243 Pa×s 463.43 Calculated Property
η 0.0001817 Pa×s 490.47 Calculated Property
η 0.0001081 Pa×s 517.50 Calculated Property
η 0.0000678 Pa×s 544.54 Calculated Property
η 0.0000444 Pa×s 571.58 Calculated Property
η 0.0000302 Pa×s 598.62 Calculated Property

Similar Compounds

1-phenylpropane-1,2-diol. dl-Erythro-1-phenyl-1,2-propanediol. Benzenemethanol, .alpha.-ethyl-4-methoxy-. 1H-Indene-1,2-diol, 2,3-dihydro-, cis-. 1H-Indene-1,2-diol, 2,3-dihydro-, trans-. (2R,3S,5S,6R)-2,5-bis(4-Methoxyphenyl)-3,6-dimethyl-1,4-dioxane-rel-. (1S,2R)-2-(4-Allyl-2,6-dimethoxyphenoxy)-1-(3,4-dimethoxyphenyl)propan-1-ol. (1R,2S,3R)-1,4-Bis(benzo[d][1,3]dioxol-5-yl)-2,3-dimethylbutan-1-ol. 4-(3-Methyloxiranyl)-phenyl-2-methyl butyrate. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3-methoxy. (1S,2R)-2-(4-Allyl-2-methoxyphenoxy)-1-(3,4,5-trimethoxyphenyl)propan-1-ol. 1,2-Naphthalenediol, 1,2,3,4-tetrahydro-, trans-. 1,2-Naphthalenediol, 1,2,3,4-tetrahydro-, cis-. (2R,4R,5S)-2,4-bis(4-Methoxyphenyl)-5-methyl-1,3-dioxolane-rel-. (S)-1,1-bis(4-Methoxyphenyl)propan-2-ol.

Find more compounds similar to 1-(4-Methoxyphenyl)propane-1,2-diol.

Sources

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