Chemical Properties of Benzoic acid, 4-chloro-, 1-methylethyl ester (CAS 22913-11-7)

Benzoic acid, 4-chloro-, 1-methylethyl ester

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InChI
InChI=1S/C10H11ClO2/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7H,1-2H3
InChI Key
VOLPFZRDHTWKTD-UHFFFAOYSA-N
Formula
C10H11ClO2
SMILES
CC(C)OC(=O)c1ccc(Cl)cc1
Molecular Weight1
198.65
CAS
22913-11-7
Other Names
  • 4-Chlorobenzoic acid, isopropyl ester
  • Isopropyl 4-chlorobenzoate
  • Benzoic acid, 4-chloro, isopropyl ester
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Physical Properties

Property Value Unit Source
Δf -112.19 kJ/mol Joback Calculated Property
Δfgas -290.49 kJ/mol Joback Calculated Property
Δfus 18.77 kJ/mol Joback Calculated Property
Δvap 53.95 kJ/mol Joback Calculated Property
log10WS -3.35 Crippen Calculated Property
logPoct/wat 2.905 Crippen Calculated Property
McVol 147.680 ml/mol McGowan Calculated Property
Pc 2937.70 kPa Joback Calculated Property
Inp [1342.00; 1370.00]   Show Hide
Inp 1351.00 NIST
Inp 1356.00 NIST
Inp Outlier 1370.00 NIST
Inp 1354.00 NIST
Inp 1342.00 NIST
Inp 1349.00 NIST
Inp 1354.00 NIST
Inp 1351.00 NIST
I [1833.00; 1885.00]   Show Hide
I 1852.00 NIST
I 1870.00 NIST
I 1885.00 NIST
I 1878.00 NIST
I 1833.00 NIST
I 1860.00 NIST
I 1852.00 NIST
I 1878.00 NIST
Tboil 573.14 K Joback Calculated Property
Tc 796.07 K Joback Calculated Property
Tfus 328.48 K Joback Calculated Property
Vc 0.554 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [326.36; 391.97] J/mol×K [573.14; 796.07] Show Hide
Cp,gas 326.36 J/mol×K 573.14 Joback Calculated Property
Cp,gas 339.19 J/mol×K 610.30 Joback Calculated Property
Cp,gas 351.23 J/mol×K 647.45 Joback Calculated Property
Cp,gas 362.51 J/mol×K 684.61 Joback Calculated Property
Cp,gas 373.05 J/mol×K 721.76 Joback Calculated Property
Cp,gas 382.87 J/mol×K 758.92 Joback Calculated Property
Cp,gas 391.97 J/mol×K 796.07 Joback Calculated Property
η [0.0001966; 0.0020698] Pa×s [328.48; 573.14] Show Hide
η 0.0020698 Pa×s 328.48 Joback Calculated Property
η 0.0011257 Pa×s 369.26 Joback Calculated Property
η 0.0006911 Pa×s 410.03 Joback Calculated Property
η 0.0004634 Pa×s 450.81 Joback Calculated Property
η 0.0003321 Pa×s 491.59 Joback Calculated Property
η 0.0002504 Pa×s 532.36 Joback Calculated Property
η 0.0001966 Pa×s 573.14 Joback Calculated Property

Similar Compounds

4-Chlorobenzoic acid, but-3-yn-2-yl ester. 3-Chlorobenzoic acid, isopropyl ester. Ethyl-4-chlorobenzoate. Benzoic acid, 1-methylethyl ester. 4-Chlorobenzoic acid, 2-butyl ester. 2-Chlorobenzoic acid, isopropyl ester. 4-Chlorobenzoic acid, propyl ester. 4-Chlorobenzoic acid, 2-chloroethyl ester. Benzoic acid, 4-chloro, 1,2-dimethylpropyl ester. 2,2,2-Trichloro-1-cyanoethyl 4-chlorobenzoate. Benzoic acid, 4-chloro, 2,2-dichloroethyl ester. isopropyl 4-hydroxybenzoate. Benzoic acid, 4-chloro, 2-propynyl ester. Benzoic acid, 2,4-dichloro-, ethyl ester. 4-Chlorobenzoic acid, 2-methylpropyl ester.

Find more compounds similar to Benzoic acid, 4-chloro-, 1-methylethyl ester.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.