Chemical Properties of 4-Ethylbenzoic acid, pent-2-en-4-ynyl ester

4-Ethylbenzoic acid, pent-2-en-4-ynyl ester

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InChI
InChI=1S/C14H14O2/c1-3-5-6-11-16-14(15)13-9-7-12(4-2)8-10-13/h1,5-10H,4,11H2,2H3/b6-5+
InChI Key
RUVVJERLIGXFDS-AATRIKPKSA-N
Formula
C14H14O2
SMILES
C#CC=CCOC(=O)c1ccc(CC)cc1
Molecular Weight1
214.26
Sources

Physical Properties

Property Value Unit Source
Δf 239.15 kJ/mol Joback Calculated Property
Δfgas 57.09 kJ/mol Joback Calculated Property
Δfus 31.63 kJ/mol Joback Calculated Property
Δvap 58.67 kJ/mol Joback Calculated Property
logPoct/wat 2.60 Crippen Calculated Property
Pc 2500.00 kPa Joback Calculated Property
Tboil 621.95 K Joback Calculated Property
Tc 844.80 K Joback Calculated Property
Tfus 400.53 K Joback Calculated Property
Vc 0.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 429.62 J/mol×K 621.95 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

4-Butylbenzoic acid, pent-2-en-4-ynyl ester. 4-Ethylbenzoic acid, 3-methylbut-2-enyl ester. 4-Ethylbenzoic acid, 3-chloroprop-2-enyl ester. 4-Ethylbenzoic acid, ethyl ester. 4-Ethylbenzoic acid, undec-2-enyl ester. 4-Butylbenzoic acid, 3-methylbut-2-enyl ester. Terephthalic acid, di(but-2-enyl) ester. 4-Butylbenzoic acid, 3-chloroprop-2-enyl ester. P-toluic acid, 3-methylbut-2-enyl ester. 1,4-Benzenedicarboxylic acid, di-2-propenyl ester. 4-Butylbenzoic acid, undec-2-enyl ester. Benzoic acid, 4-ethyl-, methyl ester. 4-Butylbenzoic acid, ethyl ester. Ethyl 4-t-butylbenzoate. 4-Ethylbenzoic acid, oct-3-en-2-yl ester.

Find more compounds similar to 4-Ethylbenzoic acid, pent-2-en-4-ynyl ester.

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