Chemical Properties of Cyclopropanecarboxylic acid, 4-cyanophenyl ester

Cyclopropanecarboxylic acid, 4-cyanophenyl ester

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C11H9NO2/c12-7-8-1-5-10(6-2-8)14-11(13)9-3-4-9/h1-2,5-6,9H,3-4H2
InChI Key
GDMSAIHUURVTDC-UHFFFAOYSA-N
Formula
C11H9NO2
SMILES
N#Cc1ccc(OC(=O)C2CC2)cc1
Molecular Weight1
187.19
Sources

Physical Properties

Property Value Unit Source
Δf 104.53 kJ/mol Joback Calculated Property
Δfgas -52.43 kJ/mol Joback Calculated Property
Δfus 20.33 kJ/mol Joback Calculated Property
Δvap 62.57 kJ/mol Joback Calculated Property
logPoct/wat 1.87 Crippen Calculated Property
Pc 3062.55 kPa Joback Calculated Property
Tboil 667.85 K Joback Calculated Property
Tc 907.57 K Joback Calculated Property
Tfus 407.76 K Joback Calculated Property
Vc 0.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 354.92 J/mol×K 667.85 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Butyric acid, ester with p-hydroxybenzonitrile. 2-Methylpropionic acid, 4-cyanophenyl ester. 2-Ethylbutyric acid, 4-cyanophenyl ester. 2,2-Dimethylpropanoic acid, 4-cyanophenyl ester. Valeric acid, 4-cyanophenyl ester. Cyclobutanecarboxylic acid, 4-cyanophenyl ester. Succinic acid, di(4-cyanophenyl) ester. Glutaric acid, di(4-cyanophenyl) ester. 5-Chlorovaleric acid, 4-cyanophenyl ester. 5-Bromovaleric acid, 4-cyanophenyl ester. Octanoic acid, 4-cyanophenyl ester. Propanoic acid, 2-methyl-, 4-methylphenyl ester. 6-Bromohexanoic acid, 4-cyanophenyl ester. p-Cresyl isovalerate. 3-Cyclopentylpropionic acid, 4-cyanophenyl ester.

Find more compounds similar to Cyclopropanecarboxylic acid, 4-cyanophenyl ester.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.