Chemical Properties of Trimethoxycinnamaldehyde

Trimethoxycinnamaldehyde

InChI
InChI=1S/C12H14O4/c1-14-10-8-12(16-3)11(15-2)7-9(10)5-4-6-13/h4-8H,1-3H3/b5-4+
InChI Key
DNAVOCNYHNNEQI-SNAWJCMRSA-N
Formula
C12H14O4
SMILES
COc1cc(OC)c(OC)cc1/C=C/C=O
Molecular Weight1
222.24
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 25.77 kJ/mol Joback Calculated Property
logPoct/wat 1.925 Crippen Calculated Property
McVol 171.060 ml/mol McGowan Calculated Property
Inp [1845.00; 1845.00]   Show Hide
Inp 1845.00 NIST
Inp 1845.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [247.56; 526.47] 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 A7.46900e+01
Coefficient B6.91360e-01
Coefficient C-2.02880e-04
Coefficient D-3.67000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 247.56 J/mol×K 273.00 Calculated Property
Cp,gas 292.26 J/mol×K 353.78 Calculated Property
Cp,gas 333.80 J/mol×K 434.56 Calculated Property
Cp,gas 372.07 J/mol×K 515.33 Calculated Property
Cp,gas 406.95 J/mol×K 596.11 Calculated Property
Cp,gas 438.33 J/mol×K 676.89 Calculated Property
Cp,gas 466.08 J/mol×K 757.67 Calculated Property
Cp,gas 490.10 J/mol×K 838.44 Calculated Property
Cp,gas 510.27 J/mol×K 919.22 Calculated Property
Cp,gas 526.47 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0006485; 0.0001327] Pa×s [392.59; 591.07] 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-1.20662e+01
Coefficient B1.85514e+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.392.59
Temperature range, max.591.07
η 0.0006485 Pa×s 392.59 Calculated Property
η 0.0005044 Pa×s 414.64 Calculated Property
η 0.0004024 Pa×s 436.70 Calculated Property
η 0.0003281 Pa×s 458.75 Calculated Property
η 0.0002725 Pa×s 480.80 Calculated Property
η 0.0002301 Pa×s 502.85 Calculated Property
η 0.0001971 Pa×s 524.91 Calculated Property
η 0.0001709 Pa×s 546.96 Calculated Property
η 0.0001498 Pa×s 569.01 Calculated Property
η 0.0001327 Pa×s 591.07 Calculated Property

Similar Compounds

Asarone. «beta»-Asarone. (Z)-1-(2',4',5'-Trimethoxyphenyl)butadiene. Benzene-1,2,3,4-tetramethoxy-5-(propenyl). 4-Hydroxy-2-methoxycinnamaldehyde. 2,4,5-Trimethoxy-styrene. 2,3,4-Trimethoxycinnamic acid. E-Isocroweacin. 2,5-Dimethoxycinnamic acid. trans-Isoosmorhizole. 2-Propenal, 3-(3,4-dimethoxyphenyl)-. trans-2,4-Dimethoxycinnamic acid, methyl ester. (Z)-2-Methoxycinnamaldehyde. 2-Propenal, 3-(2-methoxyphenyl)-. 2-Propenoic acid, 3-(2,4-dimethoxyphenyl)-, (E)-.

Find more compounds similar to Trimethoxycinnamaldehyde.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
These property values are available through the Cheméo API. A free account gives you an access key.