Chemical Properties of Butanoic acid, 1,1-dimethyl-2-phenylethyl ester (CAS 10094-34-5)

Butanoic acid, 1,1-dimethyl-2-phenylethyl ester

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InChI
InChI=1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3
InChI Key
SHSGYHAHMQLYRB-UHFFFAOYSA-N
Formula
C14H20O2
SMILES
CCCC(=O)OC(C)(C)Cc1ccccc1
Molecular Weight1
220.31
CAS
10094-34-5
Other Names
  • Butyric acid, «alpha»,«alpha»-dimethylphenethyl ester
  • «alpha»,«alpha»-Dimethylphenethyl alcohol, butyrate
  • «alpha»,«alpha»-Dimethylphenethyl butyrate
  • Benzyl dimethylcarbinyl butyrate
  • Benzyl dimethylcarbinyl n-butyrate
  • Dimethylbenzylcarbinyl butyrate
  • Dimethyl benzyl carbinyl n-butyrate
  • 1,1-Dimethyl-2-phenylethyl butyrate
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Physical Properties

Property Value Unit Source
Δf -51.67 kJ/mol Joback Calculated Property
Δfgas -349.31 kJ/mol Joback Calculated Property
Δfus 21.43 kJ/mol Joback Calculated Property
Δvap 56.89 kJ/mol Joback Calculated Property
log10WS -3.76 Crippen Calculated Property
logPoct/wat 3.351 Crippen Calculated Property
McVol 191.800 ml/mol McGowan Calculated Property
Pc 2131.49 kPa Joback Calculated Property
Inp [1476.00; 1488.00]   Show Hide
Inp 1488.00 NIST
Inp 1476.00 NIST
I 1889.00 NIST
Tboil 619.46 K Joback Calculated Property
Tc 830.73 K Joback Calculated Property
Tfus 348.54 K Joback Calculated Property
Vc 0.725 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [497.15; 584.50] J/mol×K [619.46; 830.73] Show Hide
Cp,gas 497.15 J/mol×K 619.46 Joback Calculated Property
Cp,gas 514.27 J/mol×K 654.67 Joback Calculated Property
Cp,gas 530.30 J/mol×K 689.88 Joback Calculated Property
Cp,gas 545.29 J/mol×K 725.10 Joback Calculated Property
Cp,gas 559.29 J/mol×K 760.31 Joback Calculated Property
Cp,gas 572.34 J/mol×K 795.52 Joback Calculated Property
Cp,gas 584.50 J/mol×K 830.73 Joback Calculated Property
η [0.0001334; 0.0023056] Pa×s [348.54; 619.46] Show Hide
η 0.0023056 Pa×s 348.54 Joback Calculated Property
η 0.0010920 Pa×s 393.69 Joback Calculated Property
η 0.0006032 Pa×s 438.85 Joback Calculated Property
η 0.0003722 Pa×s 484.00 Joback Calculated Property
η 0.0002494 Pa×s 529.15 Joback Calculated Property
η 0.0001780 Pa×s 574.31 Joback Calculated Property
η 0.0001334 Pa×s 619.46 Joback Calculated Property

Similar Compounds

Benzeneethanol, «alpha»,«alpha»-dimethyl-, acetate. «beta»-Phenylethyl butyrate. Butyric acid, 2-phenyl-, isopropyl ester. Butanoic acid, 3-phenylpropyl ester. Butyric acid, 4-phenyl-, butyl ester. 2-Pentanol, 4-methyl-1-phenyl, acetate. 5-Phenylvaleric acid, isopropyl ester. Glutaric acid, butyl phenethyl ester. 5-Phenylvaleric acid, pent-2-yl ester. Butyric acid, 4-phenyl-, isobutyl ester. Glutaric acid, 2-(3-chlorophenyl)ethyl ethyl ester. Pentanoic acid, 2-phenylethyl ester. Glutaric acid, butyl 2-(3-chlorophenyl)ethyl ester. Ibuprofen, butyl ester. Butyric acid, 2-phenyl-, 1,1,1-trifluoroprop-2-yl ester.

Find more compounds similar to Butanoic acid, 1,1-dimethyl-2-phenylethyl ester.

Sources

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