Chemical Properties of Tert-butylhydroquinone, diacetate

Tert-butylhydroquinone, diacetate

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InChI
InChI=1S/C14H18O4/c1-9(15)17-11-6-7-13(18-10(2)16)12(8-11)14(3,4)5/h6-8H,1-5H3
InChI Key
SJRALGDWZXRRKL-UHFFFAOYSA-N
Formula
C14H18O4
SMILES
CC(=O)Oc1ccc(OC(C)=O)c(C(C)(C)C)c1
Molecular Weight1
250.29
Sources

Physical Properties

Property Value Unit Source
Δf -304.85 kJ/mol Joback Calculated Property
Δfgas -617.05 kJ/mol Joback Calculated Property
Δfus 23.44 kJ/mol Joback Calculated Property
Δvap 67.37 kJ/mol Joback Calculated Property
logPoct/wat 2.83 Crippen Calculated Property
Pc 2163.33 kPa Joback Calculated Property
Tboil 705.71 K Joback Calculated Property
Tc 922.82 K Joback Calculated Property
Tfus 445.74 K Joback Calculated Property
Vc 0.75 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 541.74 J/mol×K 705.71 Joback Calculated Property
η 0.00 Pa×s 705.71 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 3
=C< (ring) 3
>C< 1
-CH3 5

Similar Compounds

6-Methoxythymyl isobutyrate. Phenol, 5-methyl-2-(1-methylethyl)-, acetate. 6-Methoxythymyl isobutyrate. 6-Methoxythymyl 2-methylbutyrate. Benzene, 2-(1,1-dimethylethyl)-1,4-dimethoxy-. Phenol, 2-methyl-5-(1-methylethyl)-, acetate. Phenol, 2-methyl-5-(1-methylethyl)-, acetate. 2,5-di-tert-Butyl-1,4-dimethoxybenzene. Acetic acid, 2-isopropylphenyl ester. Thymyl isobutyrate. Phenol, 3-(1,1-dimethylethyl)-4-methoxy-. thymyl valerate. 6-Methoxy thymyl tiglate. 2,5-Dimetoxycymene. 5-methyl-2-(isopropyl)phenyl isovalerate.

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