Chemical Properties of Benzoic acid, 3-methoxy- (CAS 586-38-9)

Benzoic acid, 3-methoxy-

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InChI
InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3,(H,9,10)
InChI Key
XHQZJYCNDZAGLW-UHFFFAOYSA-N
Formula
C8H8O3
SMILES
COc1cccc(C(=O)O)c1
Molecular Weight1
152.15
CAS
586-38-9
Other Names
  • 3-methoxybenzoic acid
  • m-Methoxybenzoic acid
  • m-anisic acid

Physical Properties

Property Value Unit Source
Δcsolid -3737.91 ± 0.60 kJ/mol NIST
Δf -251.48 kJ/mol Joback Calculated Property
Δfgas -446.10 ± 0.80 kJ/mol NIST
Δfsolid -553.50 ± 1.20 kJ/mol NIST
Δfus 21.90 kJ/mol Benzoic...
Δsub [107.40; 114.70] kJ/mol Show Hide
Δsub 114.70 ± 0.80 kJ/mol NIST
Δsub 107.50 ± 0.40 kJ/mol NIST
Δsub 107.40 kJ/mol NIST
Δvap 95.00 kJ/mol NIST
IE 9.10 ± 0.20 eV NIST
log10WS -1.65 Crippen Calculated Property
logPoct/wat 1.393 Crippen Calculated Property
McVol 113.130 ml/mol McGowan Calculated Property
Pc 4260.71 kPa Joback Calculated Property
Inp [1404.00; 1413.00]   Show Hide
Inp 1404.00 NIST
Inp 1413.00 NIST
Tboil 582.57 K Joback Calculated Property
Tc 787.82 K Joback Calculated Property
Tfus 382.10 K Benzoic...
Vc 0.418 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [257.47; 305.30] J/mol×K [582.57; 787.82] Show Hide
Cp,gas 257.47 J/mol×K 582.57 Joback Calculated Property
Cp,gas 266.70 J/mol×K 616.78 Joback Calculated Property
Cp,gas 275.42 J/mol×K 650.99 Joback Calculated Property
Cp,gas 283.63 J/mol×K 685.20 Joback Calculated Property
Cp,gas 291.34 J/mol×K 719.41 Joback Calculated Property
Cp,gas 298.56 J/mol×K 753.62 Joback Calculated Property
Cp,gas 305.30 J/mol×K 787.82 Joback Calculated Property
η [0.0000920; 0.0031310] Pa×s [351.84; 582.57] Show Hide
η 0.0031310 Pa×s 351.84 Joback Calculated Property
η 0.0013019 Pa×s 390.30 Joback Calculated Property
η 0.0006336 Pa×s 428.75 Joback Calculated Property
η 0.0003472 Pa×s 467.20 Joback Calculated Property
η 0.0002085 Pa×s 505.66 Joback Calculated Property
η 0.0001345 Pa×s 544.12 Joback Calculated Property
η 0.0000920 Pa×s 582.57 Joback Calculated Property
ΔfusH 24.90 kJ/mol 378.70 NIST
ΔsubH 107.40 ± 0.40 kJ/mol 318.12 NIST

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 444.20 K 1.30 NIST

Similar Compounds

m-Trifluoromethoxybenzoic acid. Benzoic acid, 3-methoxy-, methyl ester. Benzoic acid, 3,4-dimethoxy-. Benzoic acid, m-acetoxy. Benzoic acid, p-acetoxy. m-Methoxybenzoic acid, phenyl ester. 3,5-Dimethoxybenzoic acid. Benzoic acid, 3-(trifluoroacetyloxy)-. Vanillic acid. 2,5-Dimethoxybenzoic acid. 3-Methoxybenzoic acetic anhydride. m-Anisic acid, 4-methoxyphenyl ester. Benzoic acid, 3-methoxy-, trimethylsilyl ester. 3-Methoxybenzoic trifluoroacetic anhydride. Ethyl-3-methoxybenzoate.

Find more compounds similar to Benzoic acid, 3-methoxy-.

Sources

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