Chemical Properties of Eugenol (CAS 97-53-0)

Eugenol

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InChI
InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3
InChI Key
RRAFCDWBNXTKKO-UHFFFAOYSA-N
Formula
C10H12O2
SMILES
C=CCc1ccc(O)c(OC)c1
Molecular Weight1
164.20
CAS
97-53-0
Other Names
  • 1,3,4-Eugenol
  • 1-Hydroxy-2-methoxy-4-allylbenzene
  • 1-Hydroxy-2-methoxy-4-prop-2-enylbenzene
  • 2-Hydroxy-5-allylanisole
  • 2-Methoxy-1-hydroxy-4-allylbenzene
  • 2-Methoxy-4-(2-propenyl)phenol
  • 2-Methoxy-4-allylphenol
  • 2-Methoxy-4-prop-2-enylphenol
  • 2-Metoksy-4-allilofenol
  • 4-(2-Propenyl)-2-methoxyphenol
  • 4-(2-Propenyl)-2-methoxyphenol (eugenol)
  • 4-Allyl-1-hydroxy-2-methoxybenzene
  • 4-Allyl-2-methoxyphenol
  • 4-Allyl-2-rnethoxyphenol (eugenol)
  • 4-Allylcatechol-2-methyl ether
  • 4-Allylguaiacol
  • 4-Hydroxy-3-methoxyallylbenzene
  • 4-allyl-2-methoxyphenol (eugenol)
  • 4-hydroxy-3-methoxy-1-allylbenzene
  • Allylguaiacol
  • Caryophyllic acid
  • Engenol
  • Eugenic acid
  • Eugenol (2-Methoxy-4-(2-propenyl)phenol)
  • FA 100
  • FEMA No. 2467
  • NCI-C50453
  • NSC 209525
  • Phenol, 2-methoxy-4-(2-propen-1-yl)-
  • Phenol, 2-methoxy-4-(2-propenyl)-
  • Phenol, 4-allyl-2-methoxy-
  • p-Allylguaiacol
  • p-Eugenol
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Physical Properties

Property Value Unit Source
Δf -35.68 kJ/mol Joback Calculated Property
Δfgas -208.77 kJ/mol Joback Calculated Property
Δfus 21.00 kJ/mol Joback Calculated Property
Δvap 66.30 kJ/mol NIST
log10WS [-1.56; -1.56]   Show Hide
log10WS -1.56 Aq. Sol...
log10WS -1.56 Estimat...
logPoct/wat 2.129 Crippen Calculated Property
McVol 135.440 ml/mol McGowan Calculated Property
Pc 3509.58 kPa Joback Calculated Property
Inp [1319.00; 1399.00]   Show Hide
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I 2191.00 NIST
I Outlier 2213.00 NIST
I 2150.00 NIST
I 2168.00 NIST
I 2175.00 NIST
I 2183.00 NIST
I 2192.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2176.00 NIST
I 2185.00 NIST
I 2186.00 NIST
I 2159.00 NIST
I 2153.00 NIST
I 2139.00 NIST
I 2171.00 NIST
I 2152.00 NIST
I 2153.00 NIST
I 2186.00 NIST
I 2151.00 NIST
I 2186.00 NIST
I 2156.00 NIST
I 2155.00 NIST
I 2162.00 NIST
I 2167.00 NIST
I 2186.00 NIST
I 2174.00 NIST
I Outlier 2120.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2163.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2159.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2151.00 NIST
I 2150.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2191.00 NIST
I Outlier 2122.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2186.00 NIST
I 2157.00 NIST
I 2186.00 NIST
I 2162.00 NIST
I 2162.00 NIST
I 2186.00 NIST
I 2157.00 NIST
I Outlier 2118.00 NIST
I 2192.00 NIST
I 2185.00 NIST
I 2180.00 NIST
I 2159.00 NIST
I 2193.00 NIST
I 2158.00 NIST
I 2159.00 NIST
I 2175.00 NIST
I 2186.00 NIST
I 2153.00 NIST
I 2162.00 NIST
I 2150.00 NIST
I 2191.00 NIST
I 2185.00 NIST
I 2159.00 NIST
I 2167.00 NIST
I 2182.00 NIST
I 2172.00 NIST
I 2164.00 NIST
I 2151.00 NIST
I 2184.00 NIST
I 2176.00 NIST
I Outlier 2210.00 NIST
I 2177.00 NIST
I 2157.30 NIST
I 2192.00 NIST
I Outlier 2122.00 NIST
Tboil [526.40; 526.65] K Show Hide
Tboil 526.40 K NIST
Tboil 526.65 ± 1.50 K NIST
Tc 781.19 K Joback Calculated Property
Tfus 263.78 K Aq. Sol...
Vc 0.453 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [315.44; 379.59] J/mol×K [559.58; 781.19] Show Hide
Cp,gas 315.44 J/mol×K 559.58 Joback Calculated Property
Cp,gas 327.88 J/mol×K 596.52 Joback Calculated Property
Cp,gas 339.55 J/mol×K 633.45 Joback Calculated Property
Cp,gas 350.49 J/mol×K 670.39 Joback Calculated Property
Cp,gas 360.77 J/mol×K 707.32 Joback Calculated Property
Cp,gas 370.45 J/mol×K 744.26 Joback Calculated Property
Cp,gas 379.59 J/mol×K 781.19 Joback Calculated Property
Cp,liquid 343.20 J/mol×K 293.00 NIST
η [0.0000422; 0.0012460] Pa×s [373.59; 559.58] Show Hide
η 0.0012460 Pa×s 373.59 Joback Calculated Property
η 0.0005711 Pa×s 404.59 Joback Calculated Property
η 0.0002925 Pa×s 435.59 Joback Calculated Property
η 0.0001637 Pa×s 466.59 Joback Calculated Property
η 0.0000985 Pa×s 497.58 Joback Calculated Property
η 0.0000629 Pa×s 528.58 Joback Calculated Property
η 0.0000422 Pa×s 559.58 Joback Calculated Property
ΔvapH [57.70; 66.10] kJ/mol [309.00; 461.00] Show Hide
ΔvapH 66.10 kJ/mol 309.00 NIST
ΔvapH 60.30 kJ/mol 438.50 NIST
ΔvapH 57.70 kJ/mol 461.00 NIST
Pvap [3.00e-04; 0.07] kPa [281.10; 343.50] Show Hide
Pvap 3.00e-04 kPa 281.10 Vaporiz...
Pvap 3.90e-04 kPa 283.70 Vaporiz...
Pvap 6.60e-04 kPa 289.00 Vaporiz...
Pvap 1.11e-03 kPa 293.90 Vaporiz...
Pvap 1.79e-03 kPa 298.90 Vaporiz...
Pvap 2.87e-03 kPa 303.70 Vaporiz...
Pvap 4.47e-03 kPa 308.70 Vaporiz...
Pvap 7.09e-03 kPa 313.70 Vaporiz...
Pvap 0.01 kPa 318.90 Vaporiz...
Pvap 0.02 kPa 323.60 Vaporiz...
Pvap 0.02 kPa 328.60 Vaporiz...
Pvap 0.03 kPa 333.60 Vaporiz...
Pvap 0.05 kPa 338.50 Vaporiz...
Pvap 0.07 kPa 343.50 Vaporiz...
n0 1.54070 293.15 Solubil...
ρl [1022.15; 1070.90] kg/m3 [288.15; 343.15] Show Hide
ρl 1070.90 kg/m3 288.15 Experim...
ρl 1066.48 kg/m3 293.15 Experim...
ρl 1062.06 kg/m3 298.15 Experim...
ρl 1057.64 kg/m3 303.15 Experim...
ρl 1053.21 kg/m3 308.15 Experim...
ρl 1048.78 kg/m3 313.15 Experim...
ρl 1044.35 kg/m3 318.15 Experim...
ρl 1039.92 kg/m3 323.15 Experim...
ρl 1035.48 kg/m3 328.15 Experim...
ρl 1031.04 kg/m3 333.15 Experim...
ρl 1026.60 kg/m3 338.15 Experim...
ρl 1022.15 kg/m3 343.15 Experim...

Datasets

Mass density, kg/m3

Fixed Measured
Temperature, K - Liquid Pressure, kPa - Liquid Mass density, kg/m3 - Liquid
298.15 100.00 1062.0
Reference

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.65] kPa [395.40; 556.28] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.71278e+01
Coefficient B-6.37215e+03
Coefficient C-1.70150e+01
Temperature range, min.395.40
Temperature range, max.556.28
Pvap 1.33 kPa 395.40 Calculated Property
Pvap 2.85 kPa 413.28 Calculated Property
Pvap 5.70 kPa 431.15 Calculated Property
Pvap 10.78 kPa 449.03 Calculated Property
Pvap 19.37 kPa 466.90 Calculated Property
Pvap 33.29 kPa 484.78 Calculated Property
Pvap 54.96 kPa 502.65 Calculated Property
Pvap 87.57 kPa 520.53 Calculated Property
Pvap 135.15 kPa 538.40 Calculated Property
Pvap 202.65 kPa 556.28 Calculated Property

Similar Compounds

Methyleugenol. 3-Allyl-6-methoxyphenol. Safrole. Phenol, 2,6-dimethoxy-4-(2-propenyl)-. Hydroxy chavicol. Phenol, 2-methoxy-4-(2-propenyl)-, acetate. Ethyleugenol. Phenol, 4-ethyl-2-methoxy-. Homovanillin. Allylpyrocatechol monoacetate. Eugenol TMS. Eugenol, TMS. Benzene, 1,2,3-trimethoxy-5-(2-propenyl)-. 4-Allyl-1,2-diacetoxybenzene. Homovanillyl alcohol.

Find more compounds similar to Eugenol.

Mixtures

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Outlier This icon means that the value is more than 2 standard deviations away from the property mean.