Chemical Properties of (-)-trans-Myrtanyl acatate

(-)-trans-Myrtanyl acatate

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InChI
InChI=1S/C12H20O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h9-11H,4-7H2,1-3H3
InChI Key
UWHRPSXEBAXLDR-UHFFFAOYSA-N
Formula
C12H20O2
SMILES
CC(=O)OCC1CCC2CC1C2(C)C
Molecular Weight1
196.29
Other Names
  • (E)-myrtanol acetate
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Physical Properties

Property Value Unit Source
Δf -95.27 kJ/mol Joback Calculated Property
Δfgas -421.81 kJ/mol Joback Calculated Property
Δfus 19.64 kJ/mol Joback Calculated Property
Δvap 49.69 kJ/mol Joback Calculated Property
log10WS -2.53 Crippen Calculated Property
logPoct/wat 2.622 Crippen Calculated Property
McVol 165.660 ml/mol McGowan Calculated Property
Pc 2356.49 kPa Joback Calculated Property
Inp [1362.00; 1388.00]   Show Hide
Inp 1386.00 NIST
Inp 1386.00 NIST
Inp 1387.00 NIST
Inp 1375.00 NIST
Inp 1388.00 NIST
Inp 1387.00 NIST
Inp 1387.00 NIST
Inp Outlier 1362.00 NIST
Inp 1379.00 NIST
Inp 1386.00 NIST
Inp 1387.00 NIST
I [1719.00; 1719.00]   Show Hide
I 1719.00 NIST
I 1719.00 NIST
Tboil 558.90 K Joback Calculated Property
Tc 766.28 K Joback Calculated Property
Tfus 344.94 K Joback Calculated Property
Vc 0.633 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [438.95; 537.62] J/mol×K [558.90; 766.28] Show Hide
Cp,gas 438.95 J/mol×K 558.90 Joback Calculated Property
Cp,gas 457.77 J/mol×K 593.46 Joback Calculated Property
Cp,gas 475.48 J/mol×K 628.03 Joback Calculated Property
Cp,gas 492.21 J/mol×K 662.59 Joback Calculated Property
Cp,gas 508.06 J/mol×K 697.15 Joback Calculated Property
Cp,gas 523.16 J/mol×K 731.72 Joback Calculated Property
Cp,gas 537.62 J/mol×K 766.28 Joback Calculated Property

Similar Compounds

trans-Myrtanyl acetate. Bicyclo[3.1.1]heptane-2-methanol, 6,6-dimethyl-, acetate. cis-Myrtanyl acetate. amboryl (acetoxymethyl-isolongifolene) acetate. (-)-Isolongifolol, acetate. iso-Longifolol acetate. 1-Hexanol, 5-methyl-2-(1-methylethyl)-, acetate. 12-Acetoxycaryophyllene-4,5-epoxide. Verbanyl acetate. Neoverbanyl acetate. Isoverbanol acetate. neo-Verbanol, acetate. Isoverbanol, acetate. Isoverbanyl acetate. neo-Isoverbanol, acetate.

Find more compounds similar to (-)-trans-Myrtanyl acatate.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.