Chemical Properties of Adamantane-1-carboxylic acid, propyl ester

Adamantane-1-carboxylic acid, propyl ester

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InChI
InChI=1S/C14H22O2/c1-2-3-16-13(15)14-7-10-4-11(8-14)6-12(5-10)9-14/h10-12H,2-9H2,1H3
InChI Key
LVGMTYKQVATOOP-UHFFFAOYSA-N
Formula
C14H22O2
SMILES
CCCOC(=O)C12CC3CC(CC(C3)C1)C2
Molecular Weight1
222.32
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Physical Properties

Property Value Unit Source
Δf -9.97 kJ/mol Joback Calculated Property
Δfgas -369.95 kJ/mol Joback Calculated Property
Δfus 21.88 kJ/mol Joback Calculated Property
Δvap 54.36 kJ/mol Joback Calculated Property
log10WS -3.26 Crippen Calculated Property
logPoct/wat 3.156 Crippen Calculated Property
McVol 182.980 ml/mol McGowan Calculated Property
Pc 2291.52 kPa Joback Calculated Property
Inp [1603.00; 1642.00]   Show Hide
Inp 1603.00 NIST
Inp 1617.00 NIST
Inp 1629.00 NIST
Inp 1642.00 NIST
I [2027.00; 2046.00]   Show Hide
I 2027.00 NIST
I 2046.00 NIST
Tboil 616.07 K Joback Calculated Property
Tc 831.20 K Joback Calculated Property
Tfus 389.66 K Joback Calculated Property
Vc 0.704 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [527.28; 632.14] J/mol×K [616.07; 831.20] Show Hide
Cp,gas 527.28 J/mol×K 616.07 Joback Calculated Property
Cp,gas 547.19 J/mol×K 651.93 Joback Calculated Property
Cp,gas 565.89 J/mol×K 687.78 Joback Calculated Property
Cp,gas 583.56 J/mol×K 723.64 Joback Calculated Property
Cp,gas 600.38 J/mol×K 759.49 Joback Calculated Property
Cp,gas 616.52 J/mol×K 795.35 Joback Calculated Property
Cp,gas 632.14 J/mol×K 831.20 Joback Calculated Property

Similar Compounds

1-Adamantanecarboxylic acid, isobutyl ester. Adamantane-1-carboxylic acid, butyl ester. Ethyladamantane-1-carboxylate. 1-Adamantanecarboxylic acid, 2-butyl ester. 1-Adamantanecarboxylic acid, isopropyl ester. Adamantane, 3,7-dimethyl-, 1,5-dicarboxylic acid, dipentyl ester. Cyclohexanecarboxylic acid, propyl ester. 3-ethyladamantane-1-carboxylic acid, methyl ester. Adamantan-1-carboxylic acid, methyl ester. butyl 2,4-dimethylheptanoate. trans-carbomethoxy-1,3-dimethylcyclohexane. cis-1-carbomethoxy-1,3-dimethylcyclohexane. Adamantane-1-carboxylic acid, tert.-butyl ester. 3,5-dimethyladamantane-1-carboxylic acid, methyl ester. 4e-methyladamantane-1e-carboxylic acid, methyl ester.

Find more compounds similar to Adamantane-1-carboxylic acid, propyl ester.

Sources

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