Chemical Properties of trans-«beta»-Terpinyl butanoate (CAS 2153-28-8)

trans-«beta»-Terpinyl butanoate

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InChI
InChI=1S/C14H24O2/c1-5-6-13(15)16-14(3,4)12-9-7-11(2)8-10-12/h7,12H,5-6,8-10H2,1-4H3
InChI Key
LWKWNIYBQLKBMQ-UHFFFAOYSA-N
Formula
C14H24O2
SMILES
CCCC(=O)OC(C)(C)C1CC=C(C)CC1
Molecular Weight1
224.34
CAS
2153-28-8
Other Names
  • Butanoic acid, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester
  • 4-Terpinenyl ester of n-butanoic acid
  • Butyric acid, p-menth-1-en-8-yl ester
  • «alpha»-Terpinyl butyrate
  • «alpha»-Terpinyl ester of n-butanoic acid
  • Terpinyl n-butyrate
  • Terpinyl butyrate
  • 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl butyrate
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Physical Properties

Property Value Unit Source
Δf -119.30 kJ/mol Joback Calculated Property
Δfgas -485.21 kJ/mol Joback Calculated Property
Δfus 20.06 kJ/mol Joback Calculated Property
Δvap 56.00 kJ/mol Joback Calculated Property
log10WS -4.16 Crippen Calculated Property
logPoct/wat 3.855 Crippen Calculated Property
McVol 200.400 ml/mol McGowan Calculated Property
Pc 1938.95 kPa Joback Calculated Property
Inp [1514.00; 1514.00]   Show Hide
Inp 1514.00 NIST
Inp 1514.00 NIST
I 1828.00 NIST
Tboil 616.47 K Joback Calculated Property
Tc 824.04 K Joback Calculated Property
Tfus 342.78 K Joback Calculated Property
Vc 0.751 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [541.55; 642.97] J/mol×K [616.47; 824.04] Show Hide
Cp,gas 541.55 J/mol×K 616.47 Joback Calculated Property
Cp,gas 561.22 J/mol×K 651.06 Joback Calculated Property
Cp,gas 579.73 J/mol×K 685.66 Joback Calculated Property
Cp,gas 597.13 J/mol×K 720.25 Joback Calculated Property
Cp,gas 613.44 J/mol×K 754.85 Joback Calculated Property
Cp,gas 628.71 J/mol×K 789.44 Joback Calculated Property
Cp,gas 642.97 J/mol×K 824.04 Joback Calculated Property
η [0.0001460; 0.0025704] Pa×s [342.78; 616.47] Show Hide
η 0.0025704 Pa×s 342.78 Joback Calculated Property
η 0.0012035 Pa×s 388.39 Joback Calculated Property
η 0.0006610 Pa×s 434.01 Joback Calculated Property
η 0.0004068 Pa×s 479.62 Joback Calculated Property
η 0.0002724 Pa×s 525.24 Joback Calculated Property
η 0.0001945 Pa×s 570.86 Joback Calculated Property
η 0.0001460 Pa×s 616.47 Joback Calculated Property

Similar Compounds

Terpinyl valerate. «alpha»-Terpinyl isovalerate. 3-Cyclohexene-1-methanol, «alpha»,«alpha»,4-trimethyl-, propanoate. «alpha»-Terpinyl acetate. «alpha»-Terpinyl acetate. Propanoic acid, 2-methyl-, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester. «alpha»-Bisabolol, acetate. «alpha»-Bisabolol acetate. epi-«alpha»-Bisabolol, acetate. Terpinyl formate. Menth-1-en-9-yl tiglate, p-. Tau-Cadinol acetate. «alpha»-Eudesmol acetate. (S)-2,2,6-Trimethyl-6-((S)-4-methylcyclohex-3-en-1-yl)dihydro-2H-pyran-3(4H)-one. 2,2,6-Trimethyl-6-(4-methylcyclohex-3-en-1-yl)dihydro-2H-pyran-4(3H)-one.

Find more compounds similar to trans-«beta»-Terpinyl butanoate.

Sources

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