Chemical Properties of Benzoic acid, 4-fluoro-, 4-methoxyphenyl ester (CAS 80079-00-1)

Benzoic acid, 4-fluoro-, 4-methoxyphenyl ester

PDF Excel Molecule Calculator
InChI
InChI=1S/C14H11FO3/c1-17-12-6-8-13(9-7-12)18-14(16)10-2-4-11(15)5-3-10/h2-9H,1H3
InChI Key
VRXFVPQLYBARKT-UHFFFAOYSA-N
Formula
C14H11FO3
SMILES
COc1ccc(OC(=O)c2ccc(F)cc2)cc1
Molecular Weight1
246.23
CAS
80079-00-1
Other Names
  • 4-Fluorobenzoic acid, 4-methoxyphenyl ester
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
Δf -261.17 kJ/mol Joback Calculated Property
Δfgas -455.30 kJ/mol Joback Calculated Property
Δfus 26.38 kJ/mol Joback Calculated Property
Δvap 63.38 kJ/mol Joback Calculated Property
log10WS -4.01 Crippen Calculated Property
logPoct/wat 3.054 Crippen Calculated Property
McVol 175.680 ml/mol McGowan Calculated Property
Pc 2640.67 kPa Joback Calculated Property
Inp [1859.00; 1859.00]   Show Hide
Inp 1859.00 NIST
Inp 1859.00 NIST
Tboil 681.02 K Joback Calculated Property
Tc 910.83 K Joback Calculated Property
Tfus 420.40 K Joback Calculated Property
Vc 0.663 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [446.99; 514.66] J/mol×K [681.02; 910.83] Show Hide
Cp,gas 446.99 J/mol×K 681.02 Joback Calculated Property
Cp,gas 460.77 J/mol×K 719.32 Joback Calculated Property
Cp,gas 473.53 J/mol×K 757.62 Joback Calculated Property
Cp,gas 485.28 J/mol×K 795.93 Joback Calculated Property
Cp,gas 496.05 J/mol×K 834.23 Joback Calculated Property
Cp,gas 505.83 J/mol×K 872.53 Joback Calculated Property
Cp,gas 514.66 J/mol×K 910.83 Joback Calculated Property

Similar Compounds

4-Fluorobenzoic acid, phenyl ester. 3,4-Difluorobenzoic acid, 4-methoxyphenyl ester. 3-Fluorobenzoic acid, 4-methoxyphenyl ester. 4-Fluorobenzoic acid, 4-cyanophenyl ester. 4-Fluorobenzoic acid, 4-chlorophenyl ester. 2,4-Difluorobenzoic acid, 4-methoxyphenyl ester. p-Anisic acid, 4-methoxyphenyl ester. 2-Fluorobenzoic acid, 4-methoxyphenyl ester. Benzoic acid, 4-fluoro-, 2-naphtyl ester. 4-Fluorobenzoic acid, 4-benzyloxyphenyl ester. Benzoic acid, p-chloro-, p-methoxyphenyl ester. 4-Trifluoromethylbenzoic acid, 4-methoxyphenyl ester. 3,4-Difluorobenzoic acid, phenyl ester. Benzoic acid, 4-methoxy-, phenyl ester. 2,5-Difluorobenzoic acid, 4-methoxyphenyl ester.

Find more compounds similar to Benzoic acid, 4-fluoro-, 4-methoxyphenyl ester.

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.