Chemical Properties of thymyl valerate

thymyl valerate

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C15H22O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h8-11H,5-7H2,1-4H3
InChI Key
RIJOKQDIPZLLFF-UHFFFAOYSA-N
Formula
C15H22O2
SMILES
CCCCC(=O)Oc1cc(C)ccc1C(C)C
Molecular Weight1
234.33
Sources

Physical Properties

Property Value Unit Source
Δf -67.79 kJ/mol Joback Calculated Property
Δfgas -389.42 kJ/mol Joback Calculated Property
Δfus 27.13 kJ/mol Joback Calculated Property
Δvap 61.35 kJ/mol Joback Calculated Property
logPoct/wat 4.21 Crippen Calculated Property
Pc 1885.44 kPa Joback Calculated Property
Tboil 655.09 K Joback Calculated Property
Tc 857.92 K Joback Calculated Property
Tfus 367.43 K Joback Calculated Property
Vc 0.79 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 546.23 J/mol×K 655.09 Joback Calculated Property
η 0.00 Pa×s 655.09 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
>C=O (nonring) 1
=CH- (ring) 3
=C< (ring) 3
-CH2- 3
-CH3 4

Similar Compounds

5-methyl-2-(isopropyl)phenyl isovalerate. Thymyl 2-methylbutyrate. Thymyl isobutyrate. Glutaric acid, di(2-isopropylphenyl) ester. 6-Methoxythymyl isobutyrate. Sebacic acid, di(2-isopropylphenyl) ester. Phenol, 5-methyl-2-(1-methylethyl)-, acetate. 6-Methoxythymyl 2-methylbutyrate. Thymyl methacrylate. isothymyl butyrate. Glutaric acid, monochloride, 2-isopropylphenyl ester. 6-Methoxythymyl isobutyrate. Glutaric acid, ethyl 2-isopropylphenyl ester. Glutaric acid, 2-isopropylphenyl propyl ester. Glutaric acid, di(2-ethylphenyl) ester.

Find more compounds similar to thymyl valerate.

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.