Chemical Properties of 8,9-Dehydrothymol isobutyrate

8,9-Dehydrothymol isobutyrate

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

InChI
InChI=1S/C14H18O2/c1-9(2)12-7-6-11(5)13(8-12)16-14(15)10(3)4/h6-8,10H,1H2,2-5H3
InChI Key
KICUJBIVPALHON-UHFFFAOYSA-N
Formula
C14H18O2
SMILES
C=C(C)c1ccc(C)c(OC(=O)C(C)C)c1
Molecular Weight1
218.29
Sources

Physical Properties

Property Value Unit Source
Δf 3.08 kJ/mol Joback Calculated Property
Δfgas -253.14 kJ/mol Joback Calculated Property
Δfus 21.95 kJ/mol Joback Calculated Property
Δvap 58.54 kJ/mol Joback Calculated Property
logPoct/wat 3.590 Crippen Calculated Property
Pc 2143.35 kPa Joback Calculated Property
Tboil 628.77 K Joback Calculated Property
Tc 841.84 K Joback Calculated Property
Tfus 340.44 K Joback Calculated Property
Vc 0.712 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 471.75 J/mol×K 628.77 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Carvacrol isobutyrate. 8,9-Dehydrothymyl isobutyrate. 8,9-Dehydrothymyl 2-methylbutyrate. isothymyl butyrate. Thymyl isobutyrate. 6-Methoxythymyl isobutyrate. 8,9-Dehydrothymyl methacrylate. 8,9-Dehydrothymyl isovalerate. 6-Methoxy 8,9-dehydro-thymyl tiglate. Phenol, 2-methyl-5-(1-methylethyl)-, acetate. Phenol, 2-methyl-5-(1-methylethyl)-, acetate. Thymyl 2-methylbutyrate. 6-Methoxythymyl 2-methylbutyrate. Thymyl methacrylate. Isobutyric acid, 2,3-dimethylphenyl ester.

Find more compounds similar to 8,9-Dehydrothymol isobutyrate.

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.