Chemical Properties of 1-Naphthoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester

1-Naphthoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester

InChI
InChI=1S/C22H24O2/c1-5-9-17(4)21(15-14-16(2)3)24-22(23)20-13-8-11-18-10-6-7-12-19(18)20/h6-8,10-13,17,21H,2,5,9H2,1,3-4H3
InChI Key
ZADXSOUCXHUWLU-UHFFFAOYSA-N
Formula
C22H24O2
SMILES
C=C(C)C#CC(OC(=O)c1cccc2ccccc12)C(C)CCC
Molecular Weight1
320.43
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° 39.68 kJ/mol Joback Calculated Property
logPoct/wat 5.381 Crippen Calculated Property
McVol 272.160 ml/mol McGowan Calculated Property
Inp [2360.00; 2360.00]   Show Hide
Inp 2360.00 NIST
Inp 2360.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, 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 [796.59; 881.85] J/mol×K [834.37; 1067.45] Show Hide
Cp,gas 796.59 J/mol×K 834.37 Joback Calculated Property
Cp,gas 813.42 J/mol×K 873.22 Joback Calculated Property
Cp,gas 829.07 J/mol×K 912.06 Joback Calculated Property
Cp,gas 843.65 J/mol×K 950.91 Joback Calculated Property
Cp,gas 857.24 J/mol×K 989.75 Joback Calculated Property
Cp,gas 869.94 J/mol×K 1028.60 Joback Calculated Property
Cp,gas 881.85 J/mol×K 1067.45 Joback Calculated Property

Similar Compounds

Isophthalic acid, di(2,6-dimethylnon-1-en-3-yn-5-yl) ester. 4-Cyanobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. p-Toluic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl propyl ester. 4-Fluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ethyl ester. 4-(Ttifluoromethyl)benzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. p-Anisic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 4-Chlorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 3-Trifluoromethylbenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 3-Fluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 2-Fluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, butyl 2,6-dimethylnon-1-en-3-yn-5-yl ester. 2-Chlorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2,6-dimethylnon-1-en-3-yn-5-yl pentyl ester.

Find more compounds similar to 1-Naphthoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl 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.