Chemical Properties of Benzeneacetic acid, «alpha»,4-dihydroxy-3-methoxy-, methyl ester (CAS 2911-74-2)

Benzeneacetic acid, «alpha»,4-dihydroxy-3-methoxy-, methyl ester

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InChI
InChI=1S/C10H12O5/c1-14-8-5-6(3-4-7(8)11)9(12)10(13)15-2/h3-5,9,11-12H,1-2H3
InChI Key
XPQNHALAUGGUJN-UHFFFAOYSA-N
Formula
C10H12O5
SMILES
COC(=O)C(O)c1ccc(O)c(OC)c1
Molecular Weight1
212.20
CAS
2911-74-2
Other Names
  • Mandelic acid, 4-hydroxy-3-methoxy-, methyl ester
  • Methyl hydroxy(4-hydroxy-3-methoxyphenyl)acetate
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Physical Properties

Property Value Unit Source
Δf -496.70 kJ/mol Joback Calculated Property
Δfgas -736.51 kJ/mol Joback Calculated Property
Δfus 25.63 kJ/mol Joback Calculated Property
Δvap 81.66 kJ/mol Joback Calculated Property
log10WS -0.95 Crippen Calculated Property
logPoct/wat 0.607 Crippen Calculated Property
McVol 153.050 ml/mol McGowan Calculated Property
Pc 3985.56 kPa Joback Calculated Property
Inp 1709.40 NIST
Tboil 730.93 K Joback Calculated Property
Tc 941.28 K Joback Calculated Property
Tfus 493.33 K Joback Calculated Property
Vc 0.508 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [419.10; 469.97] J/mol×K [730.93; 941.28] Show Hide
Cp,gas 419.10 J/mol×K 730.93 Joback Calculated Property
Cp,gas 428.88 J/mol×K 765.99 Joback Calculated Property
Cp,gas 438.09 J/mol×K 801.05 Joback Calculated Property
Cp,gas 446.77 J/mol×K 836.11 Joback Calculated Property
Cp,gas 454.95 J/mol×K 871.16 Joback Calculated Property
Cp,gas 462.68 J/mol×K 906.22 Joback Calculated Property
Cp,gas 469.97 J/mol×K 941.28 Joback Calculated Property
η [0.0000029; 0.0001497] Pa×s [493.33; 730.93] Show Hide
η 0.0001497 Pa×s 493.33 Joback Calculated Property
η 0.0000607 Pa×s 532.93 Joback Calculated Property
η 0.0000279 Pa×s 572.53 Joback Calculated Property
η 0.0000142 Pa×s 612.13 Joback Calculated Property
η 0.0000078 Pa×s 651.73 Joback Calculated Property
η 0.0000046 Pa×s 691.33 Joback Calculated Property
η 0.0000029 Pa×s 730.93 Joback Calculated Property

Similar Compounds

Mandelic acid, 3,4-dimethoxy-, methyl ester. Methyl (3,4-dimethoxyphenyl)(methoxy)acetate. 3-Hydroxymandelic acid, methyl ester. Vanillylmandelic acid, TFA-ME. Benzeneacetic acid, «alpha»-hydroxy-4-methoxy-, methyl ester. 3-Hydroxymandelic acid, dimethyl ether, methyl ester. 3,4-dihydroxymandelic acid, TFA-ME. 4-(1-Hydroxyallyl)-2-methoxyphenol. m-Hydroxymandelic acid, TFA-ME. Vanillylmandelic acid, acetyl, DTFMBz. 1,2-Dimethoxy-4-(1,2-dimethoxyethyl)benzene. Benzeneacetic acid, 3-methoxy-«alpha»,4-bis[(trimethylsilyl)oxy]-, trimethylsilyl ester. Dihydroxymandelic acid, acetyl, DTFMBz. Mandelic acid, 3,4-dihydroxy, DCTFA-acetate. Ethyl homovanillate.

Find more compounds similar to Benzeneacetic acid, «alpha»,4-dihydroxy-3-methoxy-, methyl ester.

Sources

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