Chemical Properties of 2-Propenoic acid, 3,3-diphenyl-2-(o-methoxyphenyl)- (CAS 5129-14-6)

2-Propenoic acid, 3,3-diphenyl-2-(o-methoxyphenyl)-

InChI
InChI=1S/C22H18O3/c1-25-19-15-9-8-14-18(19)21(22(23)24)20(16-10-4-2-5-11-16)17-12-6-3-7-13-17/h2-15H,1H3,(H,23,24)
InChI Key
RHDBQQXIWBILRU-UHFFFAOYSA-N
Formula
C22H18O3
SMILES
COc1ccccc1C(C(=O)O)=C(c1ccccc1)c1ccccc1
Molecular Weight1
330.38
CAS
5129-14-6
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
ω 0.8792 Relay (1.0) Calculated Property
ΔfH°gas -164.48 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 43.38 kJ/mol Joback Calculated Property
ΔvapH° 112.29 kJ/mol Relay (1.0) Calculated Property
IE 7.72 eV Relay (1.0) Calculated Property
log10WS -4.52 Relay (1.0) Calculated Property
logPoct/wat 4.739 Crippen Calculated Property
McVol 258.570 ml/mol McGowan Calculated Property
Pc 2032.72 kPa Joback Calculated Property
Tboil 691.50 K Relay (1.0) Calculated Property
Tc 1042.09 K Relay (1.0) Calculated Property
Tfus 421.46 K Relay (1.0) Calculated Property
Vc 0.904 m3/kmol Relay (1.0) Calculated Property

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [781.96; 847.41] J/mol×K [959.83; 1222.03] Show Hide
Cp,gas 781.96 J/mol×K 959.83 Joback Calculated Property
Cp,gas 794.87 J/mol×K 1003.53 Joback Calculated Property
Cp,gas 806.77 J/mol×K 1047.23 Joback Calculated Property
Cp,gas 817.80 J/mol×K 1090.93 Joback Calculated Property
Cp,gas 828.15 J/mol×K 1134.63 Joback Calculated Property
Cp,gas 837.96 J/mol×K 1178.33 Joback Calculated Property
Cp,gas 847.41 J/mol×K 1222.03 Joback Calculated Property

Similar Compounds

propyl-«delta»1-tetrahydrocannabinolic acid, n-butyl-boronate. .delta.1-tetrahydrocannabinolic acid, n-butyl-boronate. Nomifemsine M(HO), diacetylated, isomer # 2. Spiro[2H-1-benzopyran-2,2'-[2H]indole], 1',3'-dihydro-1',3',3'-trimethyl-6-nitro-. Doronenine. 3-Benzofurancarboxamide, 2,3-dihydro-3-phenyl-. Tanshinone II-b. Glyceofuran, TMS. Glyceollin I, TMS. Glyceollin II, TMS. naringin. 3,20-Dioxo-11«beta»,18-epoxy-17«alpha»,18,21-trihydroxy-4-pregnene, MO-TMS, anti. 3,20-Dioxo-11«beta»,18-epoxy-17«alpha»,18,21-trihydroxy-4-pregnene, MO-TMS, syn. 2-Acetyl-1,2,3,4,9,13b-hexahydro-2,4a-diaza-tribenzo[a,c,E]cyclohepten-7-ol, acetate (ester). DILTIAZEM, M(DESAMINO-HO-), AC.

Find more compounds similar to 2-Propenoic acid, 3,3-diphenyl-2-(o-methoxyphenyl)-.

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.
These property values are available through the Cheméo API. A free account gives you an access key.