Chemical Properties of hexyl 3,5-dinitrobenzoate (CAS 10478-04-3)

hexyl 3,5-dinitrobenzoate

PDF Excel Molecule Calculator
InChI
InChI=1S/C13H16N2O6/c1-2-3-4-5-6-21-13(16)10-7-11(14(17)18)9-12(8-10)15(19)20/h7-9H,2-6H2,1H3
InChI Key
KZVBOYCZXPUDGJ-UHFFFAOYSA-N
Formula
C13H16N2O6
SMILES
CCCCCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1
Molecular Weight1
296.28
CAS
10478-04-3
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 -11.09 kJ/mol Joback Calculated Property
Δfgas -364.38 kJ/mol Joback Calculated Property
Δfus 48.20 kJ/mol Joback Calculated Property
Δvap 90.47 kJ/mol Joback Calculated Property
log10WS -5.11 Crippen Calculated Property
logPoct/wat 3.240 Crippen Calculated Property
McVol 212.550 ml/mol McGowan Calculated Property
Pc 2278.41 kPa Joback Calculated Property
Inp [2138.00; 2182.00]   Show Hide
Inp 2138.00 NIST
Inp 2146.00 NIST
Inp 2157.00 NIST
Inp 2173.00 NIST
Inp 2182.00 NIST
Inp 2162.00 NIST
Inp 2162.00 NIST
I [3067.00; 3108.00]   Show Hide
I 3067.00 NIST
I 3089.00 NIST
I 3103.00 NIST
I 3108.00 NIST
Tboil 913.45 K Joback Calculated Property
Tc 1156.49 K Joback Calculated Property
Tfus 647.11 K Joback Calculated Property
Vc 0.844 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [644.03; 691.97] J/mol×K [913.45; 1156.49] Show Hide
Cp,gas 644.03 J/mol×K 913.45 Joback Calculated Property
Cp,gas 654.65 J/mol×K 953.96 Joback Calculated Property
Cp,gas 664.17 J/mol×K 994.46 Joback Calculated Property
Cp,gas 672.62 J/mol×K 1034.97 Joback Calculated Property
Cp,gas 680.05 J/mol×K 1075.48 Joback Calculated Property
Cp,gas 686.49 J/mol×K 1115.99 Joback Calculated Property
Cp,gas 691.97 J/mol×K 1156.49 Joback Calculated Property

Similar Compounds

dodecyl 3,5-dinitrobenzoate. heptyl 3,5-dinitrobenzoate. undecyl 3,5-dinitrobenzoate. decyl 3,5-dinitrobenzoate. octyl 3,5-dinitrobenzoate. nonyl 3,5-dinitrobenzoate. pentyl 3,5-dinitrobenzoate. butyl 3,5-dinitrobenzoate. 10-Chlorodecyl 3,5-dinitrobenzoate. 8-Chlorooctyl 3,5-dinitrobenzoate. (Z)-Dec-4-enyl 3,5-dinitrobenzoate. Hexan-2-yl 3,5-dinitrobenzoate. Decan-2-yl 3,5-dinitrobenzoate. Octan-2-yl 3,5-dinitrobenzoate. Isopentyl 3,5-dinitrobenzoate.

Find more compounds similar to hexyl 3,5-dinitrobenzoate.

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.