Chemical Properties of 1-Adamantanecarboxylic acid, 4-cyanophenyl ester

1-Adamantanecarboxylic acid, 4-cyanophenyl ester

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InChI
InChI=1S/C18H19NO2/c19-11-12-1-3-16(4-2-12)21-17(20)18-8-13-5-14(9-18)7-15(6-13)10-18/h1-4,13-15H,5-10H2
InChI Key
XCBOWRSWXPITOO-UHFFFAOYSA-N
Formula
C18H19NO2
SMILES
N#Cc1ccc(OC(=O)C23CC4CC(CC(C4)C2)C3)cc1
Molecular Weight1
281.35
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Physical Properties

Property Value Unit Source
Δf 259.67 kJ/mol Joback Calculated Property
Δfgas -62.57 kJ/mol Joback Calculated Property
Δfus 27.40 kJ/mol Joback Calculated Property
Δvap 76.69 kJ/mol Joback Calculated Property
log10WS -4.62 Crippen Calculated Property
logPoct/wat 3.680 Crippen Calculated Property
McVol 216.960 ml/mol McGowan Calculated Property
Pc 2100.34 kPa Joback Calculated Property
Inp [2362.00; 2362.00]   Show Hide
Inp 2362.00 NIST
Inp 2362.00 NIST
Tboil 841.33 K Joback Calculated Property
Tc 1092.36 K Joback Calculated Property
Tfus 538.67 K Joback Calculated Property
Vc 0.846 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [696.88; 808.01] J/mol×K [841.33; 1092.36] Show Hide
Cp,gas 696.88 J/mol×K 841.33 Joback Calculated Property
Cp,gas 715.05 J/mol×K 883.17 Joback Calculated Property
Cp,gas 732.96 J/mol×K 925.01 Joback Calculated Property
Cp,gas 750.92 J/mol×K 966.85 Joback Calculated Property
Cp,gas 769.22 J/mol×K 1008.68 Joback Calculated Property
Cp,gas 788.15 J/mol×K 1050.52 Joback Calculated Property
Cp,gas 808.01 J/mol×K 1092.36 Joback Calculated Property

Similar Compounds

1-Adamantanecarboxylic acid, 4-methoxyphenyl ester. 1-Adamantanecarboxylic acid, 4-chlorophenyl ester. Cyclohexanecarboxylic acid, 4-cyanophenyl ester. 1-Adamantanecarboxylic acid, 3-methylphenyl ester. 1-Adamantanecarboxylic acid, 2-naphthyl ester. 1-Adamantanecarboxylic acid, 4-nitrophenyl ester. 1-Adamantanecarboxylic acid, 3,4-dichlorophenyl ester. Cyclopentanecarboxylic acid, 4-cyanophenyl ester. 3-Cyclopentylpropionic acid, 4-cyanophenyl ester. 1-Adamantanecarboxylic acid, 3,5-dimethylphenyl ester. 1-Adamantanecarboxylic acid , 4-benzyloxyphenyl ester. Diethylmalonic acid, di(4-cyanophenyl) ester. Cyclohexanecarboxylic acid, 4-methoxyphenyl ester. Cyclohexanecarboxylic acid, 4-butyl-, 4-ethoxyphenyl ester, trans-. 2-Ethylbutyric acid, 4-cyanophenyl ester.

Find more compounds similar to 1-Adamantanecarboxylic acid, 4-cyanophenyl ester.

Sources

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