Chemical Properties of Thymyl formate

Thymyl formate

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InChI
InChI=1S/C11H14O2/c1-8(2)10-5-4-9(3)6-11(10)13-7-12/h4-8H,1-3H3
InChI Key
IWAIRWGSZFYSES-UHFFFAOYSA-N
Formula
C11H14O2
SMILES
Cc1ccc(C(C)C)c(OC=O)c1
Molecular Weight1
178.23
Sources

Physical Properties

Property Value Unit Source
Δf -72.07 kJ/mol Joback Calculated Property
Δfgas -279.86 kJ/mol Joback Calculated Property
Δfus 17.46 kJ/mol Joback Calculated Property
Δvap 52.42 kJ/mol Joback Calculated Property
logPoct/wat 2.65 Crippen Calculated Property
Pc 2746.90 kPa Joback Calculated Property
Tboil 558.36 K Joback Calculated Property
Tc 769.26 K Joback Calculated Property
Tfus 314.42 K Joback Calculated Property
Vc 0.57 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 347.05 J/mol×K 558.36 Joback Calculated Property
η 0.00 Pa×s 558.36 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Benzene, 2-methoxy-4-methyl-1-(1-methylethyl)-. Phenol, 5-methyl-2-(1-methylethyl)-, acetate. Formic acid, 2-isopropylphenyl ester. Benzene, 1-(1,1-dimethylethyl)-2-methoxy-4-methyl-. 2,5-Dimethoxy-4-isopropyltoluene. 2,5-di-tert-Butyl-1,4-dimethoxybenzene. Acetic acid, 2-isopropylphenyl ester. Thymyl isobutyrate. o-Isopropylanisole. 2,5-Dimetoxycymene. Phenol, 6-methyl-2-methoxy-3-(1-methylethyl). thymyl valerate. Carvacrol methyl ether. Phenol, 2-methyl-5-(1-methylethyl)-, acetate. Phenol, 2-methyl-5-(1-methylethyl)-, acetate.

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