Chemical Properties of 3-Cyclopentylpropionic acid, hex-4-yn-3-yl ester

3-Cyclopentylpropionic acid, hex-4-yn-3-yl ester

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InChI
InChI=1S/C14H22O2/c1-3-7-13(4-2)16-14(15)11-10-12-8-5-6-9-12/h12-13H,4-6,8-11H2,1-2H3
InChI Key
BDPKCKWTSQVSMQ-UHFFFAOYSA-N
Formula
C14H22O2
SMILES
CC#CC(CC)OC(=O)CCC1CCCC1
Molecular Weight1
222.32
Sources

Physical Properties

Property Value Unit Source
Δf 69.99 kJ/mol Joback Calculated Property
Δfgas -249.59 kJ/mol Joback Calculated Property
Δfus 28.34 kJ/mol Joback Calculated Property
Δvap 57.94 kJ/mol Joback Calculated Property
logPoct/wat 3.30 Crippen Calculated Property
Pc 2127.56 kPa Joback Calculated Property
Tboil 619.85 K Joback Calculated Property
Tc 833.36 K Joback Calculated Property
Tfus 421.70 K Joback Calculated Property
Vc 0.74 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 518.77 J/mol×K 619.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 1
>C=O (nonring) 1
#C- 2
-CH2- 3
-CH3 2
>CH- (ring) 1
-CH2- (ring) 4

Similar Compounds

Sebacic acid, di(hex-4-yn-3-yl) ester. Octanoic acid, hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl propyl ester. Undec-10-ynoic acid, hex-4-yn-3-yl ester. Sebacic acid, butyl hex-4-yn-3-yl ester. Sebacic acid, heptyl hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl tridecyl ester. Sebacic acid, hex-4-yn-3-yl pentadecyl ester. Sebacic acid, hex-4-yn-3-yl undecyl ester. Sebacic acid, decyl hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl nonyl ester. Sebacic acid, hex-4-yn-3-yl tetradecyl ester. Sebacic acid, hex-4-yn-3-yl octyl ester. Sebacic acid, hexyl hex-4-yn-3-yl ester. Sebacic acid, hex-4-yn-3-yl isobutyl ester.

Find more compounds similar to 3-Cyclopentylpropionic acid, hex-4-yn-3-yl ester.

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