Chemical Properties of 4-Chlorobenzoic acid, but-3-yn-2-yl ester

4-Chlorobenzoic acid, but-3-yn-2-yl ester

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InChI
InChI=1S/C11H9ClO2/c1-3-8(2)14-11(13)9-4-6-10(12)7-5-9/h1,4-8H,2H3
InChI Key
LRAXWWFDHMSJAF-UHFFFAOYSA-N
Formula
C11H9ClO2
SMILES
C#CC(C)OC(=O)c1ccc(Cl)cc1
Molecular Weight1
208.64
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Physical Properties

Property Value Unit Source
Δf 119.30 kJ/mol Joback Calculated Property
Δfgas -19.23 kJ/mol Joback Calculated Property
Δfus 24.33 kJ/mol Joback Calculated Property
Δvap 56.03 kJ/mol Joback Calculated Property
log10WS -3.56 Crippen Calculated Property
logPoct/wat 2.518 Crippen Calculated Property
McVol 153.170 ml/mol McGowan Calculated Property
Pc 3110.57 kPa Joback Calculated Property
Inp 1419.00 NIST
Tboil 586.14 K Joback Calculated Property
Tc 820.90 K Joback Calculated Property
Tfus 386.72 K Joback Calculated Property
Vc 0.573 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [333.25; 394.26] J/mol×K [586.14; 820.90] Show Hide
Cp,gas 333.25 J/mol×K 586.14 Joback Calculated Property
Cp,gas 345.40 J/mol×K 625.27 Joback Calculated Property
Cp,gas 356.72 J/mol×K 664.39 Joback Calculated Property
Cp,gas 367.24 J/mol×K 703.52 Joback Calculated Property
Cp,gas 376.98 J/mol×K 742.65 Joback Calculated Property
Cp,gas 385.98 J/mol×K 781.77 Joback Calculated Property
Cp,gas 394.26 J/mol×K 820.90 Joback Calculated Property

Similar Compounds

Benzoic acid, 4-chloro-, 1-methylethyl ester. 2-Chlorobenzoic acid, but-3-yn-2-yl ester. 4-Fluorobenzoic acid, but-3-yn-2-yl ester. 4-Bromobenzoic acid, but-3-yn-2-yl ester. Isophthalic acid, di(but-3-yn-2-yl) ester. p-Toluic acid, but-3-yn-2-yl ester. 4-(Trifluoromethyl)benzoic acid, but-3-yn-2-yl ester. Benzoic acid, 4-chloro, 2-propynyl ester. Ethyl-4-chlorobenzoate. 3-Chlorobenzoic acid, isopropyl ester. 3-Fluorobenzoic acid, but-3-yn-2-yl ester. 3-Bromobenzoic acid, but-3-yn-2-yl ester. 4-Chlorobenzoic acid, hex-4-yn-3-yl ester. 4-Nitrobenzoic acid, but-3-yn-2-yl ester. m-Toluic acid, but-3-yn-2-yl ester.

Find more compounds similar to 4-Chlorobenzoic acid, but-3-yn-2-yl ester.

Sources

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