Chemical Properties of Vanillin, acetate (CAS 881-68-5)

Vanillin, acetate

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InChI
InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3
InChI Key
PZSJOBKRSVRODF-UHFFFAOYSA-N
Formula
C10H10O4
SMILES
COc1cc(C=O)ccc1OC(C)=O
Molecular Weight1
194.18
CAS
881-68-5
Other Names
  • Benzaldehyde, 4-(acetyloxy)-3-methoxy-
  • Acetovanillin
  • Acetylvanillin
  • O-Acetylvanillin
  • 4-Acetoxy-3-methoxybenzaldehyde
  • 4-O-Acetylvanillin
  • 4-Formyl-2-methoxyphenol acetate
  • 4-Formyl-2-methoxyphenyl acetate
  • Benzaldehyde, 4-acetoxy-3-methoxy
  • 4-(Acetyloxy)-3-methoxybenzaldehyde
  • NSC 25863
  • NSC 8499
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Physical Properties

Property Value Unit Source
Δf -311.97 kJ/mol Joback Calculated Property
Δfgas -498.74 kJ/mol Joback Calculated Property
Δfus 21.18 kJ/mol Joback Calculated Property
Δvap 59.74 kJ/mol Joback Calculated Property
log10WS -2.15 Crippen Calculated Property
logPoct/wat 1.433 Crippen Calculated Property
McVol 142.880 ml/mol McGowan Calculated Property
Pc 3177.55 kPa Joback Calculated Property
Inp [258.80; 1540.80]   Show Hide
Inp 1512.00 NIST
Inp 1465.00 NIST
Inp 1540.80 NIST
Inp 258.80 NIST
Inp 1512.00 NIST
Tboil 612.21 K Joback Calculated Property
Tc 827.41 K Joback Calculated Property
Tfus 390.31 K Joback Calculated Property
Vc 0.546 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [338.79; 397.65] J/mol×K [612.21; 827.41] Show Hide
Cp,gas 338.79 J/mol×K 612.21 Joback Calculated Property
Cp,gas 350.19 J/mol×K 648.08 Joback Calculated Property
Cp,gas 360.97 J/mol×K 683.94 Joback Calculated Property
Cp,gas 371.12 J/mol×K 719.81 Joback Calculated Property
Cp,gas 380.62 J/mol×K 755.68 Joback Calculated Property
Cp,gas 389.47 J/mol×K 791.54 Joback Calculated Property
Cp,gas 397.65 J/mol×K 827.41 Joback Calculated Property
η [0.0001978; 0.0011188] Pa×s [390.31; 612.21] Show Hide
η 0.0011188 Pa×s 390.31 Joback Calculated Property
η 0.0007397 Pa×s 427.29 Joback Calculated Property
η 0.0005224 Pa×s 464.28 Joback Calculated Property
η 0.0003883 Pa×s 501.26 Joback Calculated Property
η 0.0003007 Pa×s 538.24 Joback Calculated Property
η 0.0002406 Pa×s 575.23 Joback Calculated Property
η 0.0001978 Pa×s 612.21 Joback Calculated Property

Similar Compounds

3-Hydroxy-4-methoxybenzaldehyde, acetate. Vanillin, trifluoroacetate. 4-Ethoxy-3-anisaldehyde. 3,4-Diethoxybenzaldehyde. Vanillin, pentafluoropropionate. 1,4-Benzodioxan-6-carboxaldehyde. Ethyl Vanillin. Benzaldehyde, 3,4-dimethoxy-. 2-Methoxy-5-methylphenol, acetate. Cinnarizine M (hydroxy-methoxy-benzophenone), isomer 2, acetylated. Benzoic acid, 4-(acetyloxy)-3-methoxy-, methyl ester. Vanillin, heptafluorobutyrate. 4-Acetoxy-3-methoxyacetophenone. 4-Acetoxy-3-methoxystyrene. 2-Hydroxy-3-methoxybenzaldehyde, acetate.

Find more compounds similar to Vanillin, acetate.

Sources

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