Chemical Properties of 2-Propenoic acid, 3-phenyl-, pentyl ester (CAS 3487-99-8)

2-Propenoic acid, 3-phenyl-, pentyl ester

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InChI
InChI=1S/C14H18O2/c1-2-3-7-12-16-14(15)11-10-13-8-5-4-6-9-13/h4-6,8-11H,2-3,7,12H2,1H3/b11-10+
InChI Key
QDRJCWZGTMRXCL-ZHACJKMWSA-N
Formula
C14H18O2
SMILES
CCCCCOC(=O)C=Cc1ccccc1
Molecular Weight1
218.29
CAS
3487-99-8
Other Names
  • Amyl cinnamate
  • Cinnamic acid, pentyl ester
  • Pentyl cinnamate
  • n-Amyl cinnamate
Sources

Physical Properties

Property Value Unit Source
Δf 25.71 kJ/mol Joback Calculated Property
Δfgas -223.34 kJ/mol Joback Calculated Property
Δfus 29.05 kJ/mol Joback Calculated Property
Δvap 58.15 kJ/mol Joback Calculated Property
logPoct/wat 3.43 Crippen Calculated Property
Pc 2197.95 kPa Joback Calculated Property
Tboil 626.85 K Joback Calculated Property
Tc 834.90 K Joback Calculated Property
Tfus 341.04 K Joback Calculated Property
Vc 0.72 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 473.32 J/mol×K 626.85 Joback Calculated Property
η 0.00 Pa×s 626.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 1
=CH- (ring) 5
=C< (ring) 1
-CH2- 4
=CH- 2
>C=O (nonring) 1

Similar Compounds

trans-Amyl cinnamate. cis-Amyl cinnamate. n-Butyl cinnamate. Isoamyl cinnamate. n-Propyl cinnamate. 2-Propenoic acid, 3-phenyl-, 2-methylbutyl ester. 3-Methylbut-3-en-1-yl cinnamate. 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester. 2-Propenoic acid, 3-phenyl-, ethyl ester, (E)-. (Z)-Ethyl cinnamate. 2-Propenoic acid, 3-phenyl-, ethyl ester. 2-Propenoic acid, 3-phenyl-, cyclohexyl ester. cis-3-Hexenylcinnamate. cis-Allyl cinnamate. Allyl cinnamate.

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