Chemical Properties of Isobutyl 3-chlorobenzoate

Isobutyl 3-chlorobenzoate

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InChI
InChI=1S/C11H13ClO2/c1-8(2)7-14-11(13)9-4-3-5-10(12)6-9/h3-6,8H,7H2,1-2H3
InChI Key
DLJDIYXFPGOEBR-UHFFFAOYSA-N
Formula
C11H13ClO2
SMILES
CC(C)COC(=O)c1cccc(Cl)c1
Molecular Weight1
212.67
Other Names
  • Benzoic acid, 3-chloro, isobutyl ester
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Physical Properties

Property Value Unit Source
Δf -103.77 kJ/mol Joback Calculated Property
Δfgas -311.13 kJ/mol Joback Calculated Property
Δfus 21.36 kJ/mol Joback Calculated Property
Δvap 56.17 kJ/mol Joback Calculated Property
log10WS -3.41 Crippen Calculated Property
logPoct/wat 3.153 Crippen Calculated Property
McVol 161.770 ml/mol McGowan Calculated Property
Pc 2654.29 kPa Joback Calculated Property
Inp [1462.00; 1500.00]   Show Hide
Inp 1500.00 NIST
Inp 1466.00 NIST
Inp 1475.00 NIST
Inp 1488.00 NIST
Inp 1500.00 NIST
Inp 1477.00 NIST
Inp 1462.00 NIST
Inp 1471.00 NIST
I [1969.00; 2004.00]   Show Hide
I 1969.00 NIST
I 1969.00 NIST
I 1988.00 NIST
I 2003.00 NIST
I 2004.00 NIST
I 1969.00 NIST
I 1989.00 NIST
Tboil 596.02 K Joback Calculated Property
Tc 814.94 K Joback Calculated Property
Tfus 339.75 K Joback Calculated Property
Vc 0.611 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [373.26; 443.15] J/mol×K [596.02; 814.94] Show Hide
Cp,gas 373.26 J/mol×K 596.02 Joback Calculated Property
Cp,gas 386.90 J/mol×K 632.51 Joback Calculated Property
Cp,gas 399.73 J/mol×K 668.99 Joback Calculated Property
Cp,gas 411.74 J/mol×K 705.48 Joback Calculated Property
Cp,gas 422.97 J/mol×K 741.97 Joback Calculated Property
Cp,gas 433.43 J/mol×K 778.45 Joback Calculated Property
Cp,gas 443.15 J/mol×K 814.94 Joback Calculated Property
η [0.0001789; 0.0019955] Pa×s [339.75; 596.02] Show Hide
η 0.0019955 Pa×s 339.75 Joback Calculated Property
η 0.0010666 Pa×s 382.46 Joback Calculated Property
η 0.0006465 Pa×s 425.17 Joback Calculated Property
η 0.0004294 Pa×s 467.88 Joback Calculated Property
η 0.0003054 Pa×s 510.60 Joback Calculated Property
η 0.0002290 Pa×s 553.31 Joback Calculated Property
η 0.0001789 Pa×s 596.02 Joback Calculated Property

Similar Compounds

Neopentyl 3-chlorobenzoate. Benzoic acid, 3-chloro, propyl ester. 2-Chlorobenzoic acid, 2-methylpropyl ester. 3-Chlorobenzoic acid, 2-methylbutyl ester. 4-Chlorobenzoic acid, 2-methylpropyl ester. Butyl 3-chlorobenzoate. 3-Methylbutan-2-yl 3-chlorobenzoate. Benzoic acid, 2-methylpropyl ester. 3-Chloro-2-fluorobenzoic acid, isobutyl ester. Benzoic acid, 3-chloro, 3-methylbutyl ester. 2-Methylpentyl 3-chlorobenzoate. Pentyl 3-chlorobenzoate. sec-Butyl 3-chlorobenzoate. Propane-1,2-diyl bis(3-chlorobenzoate). But-3-enyl 3-chlorobenzoate.

Find more compounds similar to Isobutyl 3-chlorobenzoate.

Sources

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