Chemical Properties of Sebacic acid, diphenyl ester

Sebacic acid, diphenyl ester

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InChI
InChI=1S/C22H26O4/c23-21(25-19-13-7-5-8-14-19)17-11-3-1-2-4-12-18-22(24)26-20-15-9-6-10-16-20/h5-10,13-16H,1-4,11-12,17-18H2
InChI Key
ODVYFOLTLWONHF-UHFFFAOYSA-N
Formula
C22H26O4
SMILES
O=C(CCCCCCCCC(=O)Oc1ccccc1)Oc1ccccc1
Molecular Weight1
354.44
Sources

Physical Properties

Property Value Unit Source
Δf -108.66 kJ/mol Joback Calculated Property
Δfgas -513.95 kJ/mol Joback Calculated Property
Δfus 46.39 kJ/mol Joback Calculated Property
Δvap 87.43 kJ/mol Joback Calculated Property
logPoct/wat 5.32 Crippen Calculated Property
Pc 1506.98 kPa Joback Calculated Property
Tboil 908.70 K Joback Calculated Property
Tc 1129.57 K Joback Calculated Property
Tfus 534.86 K Joback Calculated Property
Vc 1.10 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 898.88 J/mol×K 908.7 Joback Calculated Property
η 0.00 Pa×s 908.7 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=C< (ring) 2
-CH2- 8
>C=O (nonring) 2
=CH- (ring) 10

Similar Compounds

Myristic acid, phenyl ester. Heptanoic acid, phenyl ester. Hexanoic acid, phenyl ester. Adipic acid, diphenyl ester. Myristic acid, 4-methoxyphenyl ester. Octanoic acid, 4-methoxyphenyl ester. Pentanoic acid, phenyl ester. Sebacic acid, di(4-isopropoxyphenyl) ester. Valeric acid, 4-methoxyphenyl ester. Butanoic acid, phenyl ester. Sebacic acid, ethyl phenyl ester. 6-Bromohexanoic acid, 4-methoxyphenyl ester. Sebacic acid, phenyl propyl ester. Sebacic acid, butyl phenyl ester. Octanoic acid, 4-chlorophenyl ester.

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