Chemical Properties of 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester (CAS 122-67-8)

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

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InChI
InChI=1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+
InChI Key
IQZUZPKOFSOVET-CMDGGOBGSA-N
Formula
C13H16O2
SMILES
CC(C)COC(=O)C=Cc1ccccc1
Molecular Weight1
204.26
CAS
122-67-8
Other Names
  • Cinnamic acid, isobutyl ester
  • Isobutyl cinnamate
  • Labdanol
  • Isobutyl cinammate
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Physical Properties

Property Value Unit Source
Δf 14.85 kJ/mol Joback Calculated Property
Δfgas -207.98 kJ/mol Joback Calculated Property
Δfus 22.93 kJ/mol Joback Calculated Property
Δvap 55.53 kJ/mol Joback Calculated Property
log10WS -3.01 Crippen Calculated Property
logPoct/wat 2.899 Crippen Calculated Property
McVol 173.410 ml/mol McGowan Calculated Property
Pc 2429.05 kPa Joback Calculated Property
Inp [1598.00; 1619.00]   Show Hide
Inp 1598.00 NIST
Inp 1601.00 NIST
Inp 1619.00 NIST
Inp 1598.00 NIST
Inp 1619.00 NIST
Inp 1601.00 NIST
Inp 1598.00 NIST
I [2230.00; 2255.00]   Show Hide
I 2230.00 NIST
I 2255.00 NIST
I 2230.00 NIST
Tboil 603.53 K Joback Calculated Property
Tc 819.28 K Joback Calculated Property
Tfus 314.77 K Joback Calculated Property
Vc 0.653 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [423.50; 503.60] J/mol×K [603.53; 819.28] Show Hide
Cp,gas 423.50 J/mol×K 603.53 Joback Calculated Property
Cp,gas 439.17 J/mol×K 639.49 Joback Calculated Property
Cp,gas 453.85 J/mol×K 675.45 Joback Calculated Property
Cp,gas 467.59 J/mol×K 711.40 Joback Calculated Property
Cp,gas 480.44 J/mol×K 747.36 Joback Calculated Property
Cp,gas 492.43 J/mol×K 783.32 Joback Calculated Property
Cp,gas 503.60 J/mol×K 819.28 Joback Calculated Property
η [0.0001338; 0.0025937] Pa×s [314.77; 603.53] Show Hide
η 0.0025937 Pa×s 314.77 Joback Calculated Property
η 0.0011404 Pa×s 362.90 Joback Calculated Property
η 0.0006078 Pa×s 411.02 Joback Calculated Property
η 0.0003696 Pa×s 459.15 Joback Calculated Property
η 0.0002470 Pa×s 507.28 Joback Calculated Property
η 0.0001770 Pa×s 555.40 Joback Calculated Property
η 0.0001338 Pa×s 603.53 Joback Calculated Property

Similar Compounds

n-Propyl cinnamate. 2-Propenoic acid, 3-phenyl-, 2-methylbutyl ester. n-Butyl cinnamate. Isoamyl cinnamate. trans-Amyl cinnamate. 2-Propenoic acid, 3-phenyl-, pentyl ester. cis-Amyl cinnamate. 2-Propenoic acid, 3-phenyl-, ethyl ester, (E)-. (Z)-Ethyl cinnamate. 2-Propenoic acid, 3-phenyl-, ethyl ester. Allyl cinnamate. cis-Allyl cinnamate. cis-3-Hexenylcinnamate. 2-Propenoic acid, 3-phenyl-, 1-methylethyl ester. 3-Methyl-2-buten- 1-yl cinnamate.

Find more compounds similar to 2-Propenoic acid, 3-phenyl-, 2-methylpropyl ester.

Sources

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