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

Benzeneacetic acid, 4-chloro-, but-3-yn-2-yl ester

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InChI
InChI=1S/C12H11ClO2/c1-3-9(2)15-12(14)8-10-4-6-11(13)7-5-10/h1,4-7,9H,8H2,2H3
InChI Key
NAZJGJYUQCSYDH-UHFFFAOYSA-N
Formula
C12H11ClO2
SMILES
C#CC(C)OC(=O)Cc1ccc(Cl)cc1
Molecular Weight1
222.67
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Physical Properties

Property Value Unit Source
Δf 127.72 kJ/mol Joback Calculated Property
Δfgas -39.87 kJ/mol Joback Calculated Property
Δfus 26.92 kJ/mol Joback Calculated Property
Δvap 58.25 kJ/mol Joback Calculated Property
log10WS -3.40 Crippen Calculated Property
logPoct/wat 2.447 Crippen Calculated Property
McVol 167.260 ml/mol McGowan Calculated Property
Pc 2802.44 kPa Joback Calculated Property
Inp [1564.00; 1564.00]   Show Hide
Inp 1564.00 NIST
Inp 1564.00 NIST
Tboil 609.02 K Joback Calculated Property
Tc 839.12 K Joback Calculated Property
Tfus 397.99 K Joback Calculated Property
Vc 0.628 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [379.92; 445.42] J/mol×K [609.02; 839.12] Show Hide
Cp,gas 379.92 J/mol×K 609.02 Joback Calculated Property
Cp,gas 392.92 J/mol×K 647.37 Joback Calculated Property
Cp,gas 405.04 J/mol×K 685.72 Joback Calculated Property
Cp,gas 416.32 J/mol×K 724.07 Joback Calculated Property
Cp,gas 426.79 J/mol×K 762.42 Joback Calculated Property
Cp,gas 436.48 J/mol×K 800.77 Joback Calculated Property
Cp,gas 445.42 J/mol×K 839.12 Joback Calculated Property

Similar Compounds

Benzeneacetic acid, 1-methyl-2-propynyl ester. 1-Naphthaleneacetic acid, but-3-yn-2-yl ester. Benzeneacetic acid, 4-chloro-, hex-4-yn-3-yl ester. Benzeneacetic acid, 4-nitro-, but-3-yn-2-yl ester. Benzeneacetic acid 1-methylethyl ester. Phenylacetic acid, 4-chloro-, propyl ester. Benzeneacetic acid, 4-chloro-, 3-methylbut-2-en-1-yl ester. Benzeneacetic acid, 4-chloro-, tridec-2-yn-1-yl ester. Phenylacetic acid, 4-chloro-, butyl ester. Phenylacetic acid, 4-chloro-, nonyl ester. Phenylacetic acid, 4-chloro-, undecyl ester. Phenylacetic acid, 4-chloro-, octyl ester. Phenylacetic acid, 4-chloro-, dodecyl ester. Phenylacetic acid, 4-chloro-, heptadecyl ester. Phenylacetic acid, 4-chloro-, tridecyl ester.

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

Sources

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