Chemical Properties of 1-Naphthaleneacetic acid, 2-chloro-6-fluorophenyl ester

1-Naphthaleneacetic acid, 2-chloro-6-fluorophenyl ester

InChI
InChI=1S/C18H12ClFO2/c19-15-9-4-10-16(20)18(15)22-17(21)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2
InChI Key
UGLDIXOMFHNHGZ-UHFFFAOYSA-N
Formula
C18H12ClFO2
SMILES
O=C(Cc1cccc2ccccc12)Oc1c(F)cccc1Cl
Molecular Weight1
314.74
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° 37.96 kJ/mol Joback Calculated Property
IE 7.83 eV Relay (1.0) Calculated Property
log10WS -5.76 Relay (1.0) Calculated Property
logPoct/wat 4.780 Crippen Calculated Property
McVol 218.950 ml/mol McGowan Calculated Property
Inp [2981.00; 2981.00]   Show Hide
Inp 2981.00 NIST
Inp 2981.00 NIST
Tfus 359.60 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, 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 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [580.95; 641.45] J/mol×K [793.64; 1036.51] Show Hide
Cp,gas 580.95 J/mol×K 793.64 Joback Calculated Property
Cp,gas 593.62 J/mol×K 834.12 Joback Calculated Property
Cp,gas 605.13 J/mol×K 874.60 Joback Calculated Property
Cp,gas 615.59 J/mol×K 915.07 Joback Calculated Property
Cp,gas 625.07 J/mol×K 955.55 Joback Calculated Property
Cp,gas 633.66 J/mol×K 996.03 Joback Calculated Property
Cp,gas 641.45 J/mol×K 1036.51 Joback Calculated Property

Similar Compounds

1-Naphthaleneacetic acid, 2,3-dichlorophenyl ester. 1-Naphthaleneacetic acid, 3-chlorophenyl ester. Butyric acid, 2-phenyl-, 2-chloro-6-fluorophenyl ester. Succinic acid, 2-chloro-6-fluorophenyl 2-naphthylmethyl ester. Glutaric acid, naphth-2-ylmethyl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl phenethyl ester. Succinic acid, 2-chloro-6-fluorophenyl 3-ethylphenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-ethylphenyl ester. Fumaric acid, 2-phenethyl 2-chloro-6-fluorophenyl ester. Succinic acid, 2-chloro-6-fluorophenyl phenethyl ester. Succinic acid, 2-chloro-6-fluorophenyl 2-propylphenyl ester. Phenylacetic acid, 2-chlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-propylphenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-phenylpropyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-isopropylphenyl ester.

Find more compounds similar to 1-Naphthaleneacetic acid, 2-chloro-6-fluorophenyl 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.
These property values are available through the Cheméo API. A free account gives you an access key.