Chemical Properties of Benzeneacetic acid (CAS 103-82-2)

Benzeneacetic acid

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InChI
InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
InChI Key
WLJVXDMOQOGPHL-UHFFFAOYSA-N
Formula
C8H8O2
SMILES
O=C(O)Cc1ccccc1
Molecular Weight1
136.15
CAS
103-82-2
Other Names
  • 2-Phenylacetic acid
  • Acetic acid, phenyl-
  • Benzenacetic acid
  • Kyselina fenyloctova
  • NSC 125718
  • Phenylacetic acid
  • Phenylethanoic acid
  • benzeneethanoic acid
  • «alpha»-Toluic acid
  • «omega»-Phenylacetic acid
  • «alpha»-Toluic acid
  • «omega»-Phenylacetic acid
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Physical Properties

Property Value Unit Source
Δcsolid [-3910.00; -3896.70] kJ/mol Show Hide
Δcsolid -3896.70 ± 0.80 kJ/mol NIST
Δcsolid -3897.00 kJ/mol NIST
Δcsolid -3905.00 kJ/mol NIST
Δcsolid -3910.00 kJ/mol NIST
Δf -136.85 kJ/mol Joback Calculated Property
Δfgas -236.73 kJ/mol Joback Calculated Property
Δfus 16.20 kJ/mol Joback Calculated Property
Δsub [93.50; 99.00] kJ/mol Show Hide
Δsub 93.50 ± 0.30 kJ/mol NIST
Δsub 99.00 ± 0.60 kJ/mol NIST
Δvap 79.10 ± 0.30 kJ/mol NIST
IE [8.26; 9.10] eV Show Hide
IE 8.26 eV NIST
IE 8.26 eV NIST
IE 8.26 eV NIST
IE 8.72 eV NIST
IE 9.10 eV NIST
log10WS -0.89 Aq. Sol...
logPoct/wat 1.314 Crippen Calculated Property
McVol 107.260 ml/mol McGowan Calculated Property
Pc 3950.00 kPa Critica...
Inp [216.16; 1279.00]   Show Hide
Inp 1269.00 NIST
Inp 1254.00 NIST
Inp 1276.00 NIST
Inp 1262.00 NIST
Inp 1251.00 NIST
Inp 1248.00 NIST
Inp 1263.00 NIST
Inp 1255.00 NIST
Inp 1265.00 NIST
Inp 1246.00 NIST
Inp 1248.00 NIST
Inp 1265.00 NIST
Inp 1274.00 NIST
Inp 1263.00 NIST
Inp 1265.00 NIST
Inp 1240.00 NIST
Inp 1246.20 NIST
Inp 1265.90 NIST
Inp 1262.00 NIST
Inp 1256.00 NIST
Inp 1267.00 NIST
Inp 1265.00 NIST
Inp 1263.00 NIST
Inp 1262.00 NIST
Inp 1269.00 NIST
Inp 1269.00 NIST
Inp 1269.00 NIST
Inp 1270.00 NIST
Inp 1262.00 NIST
Inp 1252.00 NIST
Inp 1279.00 NIST
Inp 1251.00 NIST
Inp 1257.00 NIST
Inp 1257.00 NIST
Inp 1257.00 NIST
Inp 1252.00 NIST
Inp 1262.00 NIST
Inp 1236.00 NIST
Inp 1236.00 NIST
Inp 1236.00 NIST
Inp 1264.00 NIST
Inp 1268.00 NIST
Inp 1262.00 NIST
Inp 1262.00 NIST
Inp 1262.00 NIST
Inp 1276.00 NIST
Inp 1262.00 NIST
Inp 1249.00 NIST
Inp 1249.00 NIST
Inp 1249.00 NIST
Inp 1249.00 NIST
Inp 1233.00 NIST
Inp 1230.00 NIST
Inp 1212.00 NIST
Inp 1262.00 NIST
Inp Outlier 216.16 NIST
Inp 1246.20 NIST
Inp 1265.00 NIST
Inp Outlier 216.16 NIST
Inp 1269.00 NIST
Inp 1252.00 NIST
Inp 1257.00 NIST
Inp 1236.00 NIST
Inp 1268.00 NIST
Inp 1262.00 NIST
Inp 1233.00 NIST
Inp 1254.00 NIST
Inp 1263.00 NIST
I [2519.00; 2610.00]   Show Hide
I 2565.00 NIST
I 2561.00 NIST
I 2585.00 NIST
I 2540.00 NIST
I 2543.00 NIST
I 2569.00 NIST
I 2581.00 NIST
I 2556.00 NIST
I 2569.00 NIST
I 2578.00 NIST
I 2581.00 NIST
I 2589.00 NIST
I 2590.00 NIST
I 2548.00 NIST
I 2574.00 NIST
I Outlier 2519.00 NIST
I 2540.00 NIST
I 2578.00 NIST
I 2555.00 NIST
I 2569.00 NIST
I 2568.00 NIST
I 2573.00 NIST
I Outlier 2521.00 NIST
I 2568.00 NIST
I 2554.00 NIST
I 2582.00 NIST
I 2561.00 NIST
I 2557.00 NIST
I 2570.00 NIST
I 2570.00 NIST
I 2530.00 NIST
I 2570.00 NIST
I 2569.00 NIST
I 2595.00 NIST
I 2550.00 NIST
I 2550.00 NIST
I 2528.00 NIST
I 2545.00 NIST
I 2553.00 NIST
I 2560.00 NIST
I 2551.00 NIST
I 2539.00 NIST
I 2550.00 NIST
I 2550.00 NIST
I 2578.00 NIST
I 2592.00 NIST
I 2601.00 NIST
I 2601.00 NIST
I 2585.00 NIST
I 2575.00 NIST
I 2597.00 NIST
I 2548.00 NIST
I 2548.00 NIST
I 2585.00 NIST
I 2571.00 NIST
I 2565.00 NIST
I 2571.00 NIST
I 2569.00 NIST
I 2546.00 NIST
I 2534.00 NIST
I 2534.00 NIST
I 2550.00 NIST
I 2568.00 NIST
I 2568.00 NIST
I 2568.00 NIST
I Outlier 2610.00 NIST
I 2560.00 NIST
I 2574.00 NIST
I Outlier 2519.00 NIST
I 2566.00 NIST
I 2564.00 NIST
I 2551.00 NIST
I 2577.00 NIST
I 2553.00 NIST
I 2553.00 NIST
I 2548.00 NIST
I 2551.00 NIST
I 2585.00 NIST
I 2538.00 NIST
I 2555.00 NIST
I 2565.00 NIST
I 2569.00 NIST
I 2581.00 NIST
I Outlier 2519.00 NIST
I 2568.00 NIST
I 2560.00 NIST
I 2551.00 NIST
I 2554.00 NIST
I 2570.00 NIST
I 2550.00 NIST
I 2528.00 NIST
I 2539.00 NIST
I 2601.00 NIST
I 2548.00 NIST
I 2571.00 NIST
Tboil 538.70 K NIST
Tc 761.48 K Joback Calculated Property
Tfus [348.00; 350.32] K Show Hide
Tfus 350.32 K Aq. Sol...
Tfus 348.00 ± 2.00 K NIST
Tfus 349.15 ± 1.00 K NIST
Tfus 350.00 ± 2.00 K NIST
Tfus 348.05 ± 0.60 K NIST
Vc 0.401 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [236.77; 285.72] J/mol×K [555.17; 761.48] Show Hide
Cp,gas 236.77 J/mol×K 555.17 Joback Calculated Property
Cp,gas 246.37 J/mol×K 589.55 Joback Calculated Property
Cp,gas 255.36 J/mol×K 623.94 Joback Calculated Property
Cp,gas 263.77 J/mol×K 658.32 Joback Calculated Property
Cp,gas 271.61 J/mol×K 692.71 Joback Calculated Property
Cp,gas 278.92 J/mol×K 727.09 Joback Calculated Property
Cp,gas 285.72 J/mol×K 761.48 Joback Calculated Property
η [0.0001265; 0.0079644] Pa×s [317.09; 555.17] Show Hide
η 0.0079644 Pa×s 317.09 Joback Calculated Property
η 0.0027201 Pa×s 356.77 Joback Calculated Property
η 0.0011519 Pa×s 396.45 Joback Calculated Property
η 0.0005703 Pa×s 436.13 Joback Calculated Property
η 0.0003175 Pa×s 475.81 Joback Calculated Property
η 0.0001935 Pa×s 515.49 Joback Calculated Property
η 0.0001265 Pa×s 555.17 Joback Calculated Property
ΔfusH [14.49; 16.50] kJ/mol [349.20; 350.80] Show Hide
ΔfusH 15.20 kJ/mol 349.20 NIST
ΔfusH 14.49 kJ/mol 349.90 NIST
ΔfusH 14.49 kJ/mol 349.90 NIST
ΔfusH 16.50 kJ/mol 350.80 NIST
ΔsubH 98.60 ± 0.40 kJ/mol 313.00 NIST
ΔvapH 65.00 kJ/mol 454.50 NIST

Similar Compounds

1,4-Phenylenediacetic acid. p-Tolylacetic acid. m-Tolylacetic acid. Benzeneacetic acid, 4-chloro-. 4-Iodophenylacetic acid. 2-Naphthaleneacetic acid. 4-Bromophenylacetic acid. («alpha»,«alpha»,«alpha»-Trifluoro-p-tolyl)-acetic acid. 4-Ethylphenylacetic acid. Benzeneacetic acid, 4-fluoro-. m-Chlorophenylacetic acid. Benzeneacetic acid, methyl ester. 3-Bromophenylacetic acid. Benzeneacetic acid, 4-hydroxy-. 3-Fluorophenylacetic acid.

Find more compounds similar to Benzeneacetic acid.

Sources

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