Chemical Properties of Sebacic acid, isobutyl 2-nitrophenyl ester

Sebacic acid, isobutyl 2-nitrophenyl ester

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InChI
InChI=1S/C20H29NO6/c1-16(2)15-26-19(22)13-7-5-3-4-6-8-14-20(23)27-18-12-10-9-11-17(18)21(24)25/h9-12,16H,3-8,13-15H2,1-2H3
InChI Key
ZRZARKONAQXODI-UHFFFAOYSA-N
Formula
C20H29NO6
SMILES
CC(C)COC(=O)CCCCCCCCC(=O)Oc1ccccc1[N+](=O)[O-]
Molecular Weight1
379.45
Sources

Physical Properties

Property Value Unit Source
Δf -214.43 kJ/mol Joback Calculated Property
Δfgas -736.71 kJ/mol Joback Calculated Property
Δfus 54.62 kJ/mol Joback Calculated Property
Δvap 97.57 kJ/mol Joback Calculated Property
logPoct/wat 4.82 Crippen Calculated Property
Pc 1361.64 kPa Joback Calculated Property
Tboil 992.64 K Joback Calculated Property
Tc 1219.48 K Joback Calculated Property
Tfus 627.03 K Joback Calculated Property
Vc 1.17 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 988.83 J/mol×K 992.64 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
>C=O (nonring) 2
=CH- (ring) 4
-NO2 1
=C< (ring) 2
-CH2- 9
-CH3 2

Similar Compounds

Sebacic acid, butyl 2-nitrophenyl ester. Sebacic acid, 2-nitrophenyl nonyl ester. Sebacic acid, 2-nitrophenyl pentyl ester. Pimelic acid, 2-nitrophenyl octyl ester. Sebacic acid, 2-nitrophenyl octyl ester. Pimelic acid, heptyl 2-nitrophenyl ester. Sebacic acid, hexyl 2-nitrophenyl ester. Pimelic acid, 2-nitrophenyl pentyl ester. Sebacic acid, decyl 2-nitrophenyl ester. Sebacic acid, heptyl 2-nitrophenyl ester. Pimelic acid, hexyl 2-nitrophenyl ester. Sebacic acid, ethyl 2-nitrophenyl ester. Sebacic acid, isohexyl 2-nitrophenyl ester. Glutaric acid, isobutyl 2-nitrophenyl ester. Glutaric acid, 2-nitrophenyl octyl ester.

Find more compounds similar to Sebacic acid, isobutyl 2-nitrophenyl ester.

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