Chemical Properties of coniferyl ethyl ether

coniferyl ethyl ether

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InChI
InChI=1S/C12H16O3/c1-3-15-8-4-5-10-6-7-11(13)12(9-10)14-2/h4-7,9,13H,3,8H2,1-2H3/b5-4+
InChI Key
FXTHXNMWVSIYKM-SNAWJCMRSA-N
Formula
C12H16O3
SMILES
CCOCC=Cc1ccc(O)c(OC)c1
Molecular Weight1
208.25
Sources

Physical Properties

Property Value Unit Source
Δf -131.46 kJ/mol Joback Calculated Property
Δfgas -390.48 kJ/mol Joback Calculated Property
Δfus 28.85 kJ/mol Joback Calculated Property
Δvap 63.04 kJ/mol Joback Calculated Property
logPoct/wat 2.45 Crippen Calculated Property
Pc 2808.38 kPa Joback Calculated Property
Tboil 635.24 K Joback Calculated Property
Tc 851.23 K Joback Calculated Property
Tfus 415.04 K Joback Calculated Property
Vc 0.58 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 434.61 J/mol×K 635.24 Joback Calculated Property
η 0.00 Pa×s 635.24 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
=CH- (ring) 3
=C< (ring) 3
-CH2- 2
=CH- 2
-CH3 2
-OH (phenol) 1

Similar Compounds

4-(1 E)-3-hydroxy-1-propenyl-2-methoxyphenol. (E)-4-(3-Hydroxyprop-1-en-1-yl)-2-methoxyphenol. 4-((1E)-3-Hydroxy-1-propenyl)-2-methoxyphenol. Phenol, 4-(3-hydroxy-1-propenyl)-2-methoxy-. Phenol, 2-methoxy-4-(1-propenyl)-. trans-Isoeugenol. Phenol, 2-methoxy-4-(1-propenyl)-, (Z)-. Ferulic acid ethyl ester. 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-, methyl ester. Benzene, 1,2-dimethoxy-4-(1-propenyl)-. (E)-Methyl isoeugenol. cis-Methyl isoeugenol. 2-Propenoic acid, 3-(4-hydroxy-3-methoxyphenyl)-. trans-Ferulic acid. 2-Propenal, 3-(4-hydroxy-3-methoxyphenyl)-.

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