Chemical Properties of Pimelic acid, di(2-nitro-5-fluorophenyl) ester

Pimelic acid, di(2-nitro-5-fluorophenyl) ester

InChI
InChI=1S/C19H16F2N2O8/c20-12-6-8-14(22(26)27)16(10-12)30-18(24)4-2-1-3-5-19(25)31-17-11-13(21)7-9-15(17)23(28)29/h6-11H,1-5H2
InChI Key
BZJCYBZGPKLWBO-UHFFFAOYSA-N
Formula
C19H16F2N2O8
SMILES
O=C(CCCCCC(=O)Oc1cc(F)ccc1[N+](=O)[O-])Oc1cc(F)ccc1[N+](=O)[O-]
Molecular Weight1
438.34
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° 69.11 kJ/mol Joback Calculated Property
logPoct/wat 4.243 Crippen Calculated Property
McVol 284.310 ml/mol McGowan Calculated Property
Inp [2052.00; 2052.00]   Show Hide
Inp 2052.00 NIST
Inp 2052.00 NIST
Tboil 669.62 K Relay (1.0) Calculated Property

Cheméo can also estimate 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [892.65; 900.15] J/mol×K [1126.26; 1382.63] Show Hide
Cp,gas 893.95 J/mol×K 1126.26 Joback Calculated Property
Cp,gas 897.62 J/mol×K 1168.99 Joback Calculated Property
Cp,gas 899.67 J/mol×K 1211.72 Joback Calculated Property
Cp,gas 900.15 J/mol×K 1254.44 Joback Calculated Property
Cp,gas 899.11 J/mol×K 1297.17 Joback Calculated Property
Cp,gas 896.59 J/mol×K 1339.90 Joback Calculated Property
Cp,gas 892.65 J/mol×K 1382.63 Joback Calculated Property

Similar Compounds

Pimelic acid, ethyl 2-nitro-5-fluorophenyl ester. Pimelic acid, 2-nitro-5-fluorophenyl propyl ester. Pimelic acid, butyl 2-nitro-5-fluorophenyl ester. Pimelic acid, di(2-nitrophenyl) ester. Succinic acid, di(5-fluoro-2-nitrophenyl) ester. Pimelic acid, 2-nitro-5-fluorophenyl pentyl ester. Pimelic acid, hexyl 2-nitro-5-fluorophenyl ester. Pimelic acid, isobutyl 2-nitro-5-fluorophenyl ester. Pimelic acid, 2-nitro-5-fluorophenyl octyl ester. Pimelic acid, heptyl 2-nitro-5-fluorophenyl ester. Pimelic acid, 2-nitro-5-fluorophenyl nonyl ester. Succinic acid, 5-fluoro-2-nitrophenyl 3-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2-nitrophenyl ester. Sebacic acid, ethyl 2-nitrophenyl ester. Pimelic acid, 4-methyl-2-pentyl 2-nitro-5-fluorophenyl ester.

Find more compounds similar to Pimelic acid, di(2-nitro-5-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.