![(1R,3E,7E,11R)-1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene](/cid/64-288-2/1R-3E-7E-11R-1-5-5-8-Tetramethyl-12-oxabicyclo-9-1-0-dodeca-3-7-diene.png "(1R,3E,7E,11R)-1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene")
- InChI
- InChI=1S/C15H24O/c1-12-6-7-13-15(4,16-13)10-5-9-14(2,3)11-8-12/h5,8-9,13H,6-7,10-11H2,1-4H3/b9-5+,12-8-/t13-,15-/m0/s1
- InChI Key
- QTGAEXCCAPTGLB-MQTWWMRFSA-N
- Formula
- C15H24O
- SMILES
- CC1=CCC(C)(C)C=CCC2(C)OC2CC1
- Molecular Weight1
- 220.35
- CAS
- 19888-34-7
- Other Names
-
- 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-, (1R,3E,7E,11R)-
- 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-, [1R-(1R*,3E,7E,11R*)]-
- 1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene-, (1R,3E,7E,11R)
- 12-Oxabicyclo[9.1.0]dodeca-3,7-diene, 1,5,5,8-tetramethyl-, (E,E)-(1R,11R)-(-)-
- Humulene-1,2-epoxide
- Humulene epoxide 2
- Humulene epoxide II
- Humulene oxide II
- «alpha»-Humulene epoxide II
- (-)-Humulene epoxide II
- Humulene 6,7-epoxide
- Humulene II epoxide
- 1,5,5,8-Tetramethyl-12-oxabicyclo[9.1.0]dodeca-3,7-diene
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfusH° | 16.79 | kJ/mol | Joback Calculated Property |
| IE | 8.57 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.247 | Crippen Calculated Property | |
| McVol | 197.760 | ml/mol | McGowan Calculated Property |
| Inp | [1559.00; 1652.00] |
|
|
| Inp | 1609.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1594.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1612.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1596.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1595.00 | NIST | |
| Inp | 1595.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1596.00 | NIST | |
| Inp | 1595.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | Outlier 1577.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1594.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | Outlier 1570.00 | NIST | |
| Inp | 1588.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | Outlier 1579.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | Outlier 1579.00 | NIST | |
| Inp | 1613.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | Outlier 1652.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | Outlier 1568.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | Outlier 1573.00 | NIST | |
| Inp | Outlier 1578.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1614.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1613.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | Outlier 1576.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | Outlier 1575.00 | NIST | |
| Inp | 1620.00 | NIST | |
| Inp | 1594.00 | NIST | |
| Inp | 1616.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1593.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1596.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1600.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1596.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1587.00 | NIST | |
| Inp | 1591.00 | NIST | |
| Inp | 1590.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1589.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1609.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1594.00 | NIST | |
| Inp | 1595.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1613.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1591.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | 1614.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | 1585.00 | NIST | |
| Inp | 1614.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1604.00 | NIST | |
| Inp | 1615.00 | NIST | |
| Inp | 1614.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1583.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1611.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | Outlier 1580.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1608.00 | NIST | |
| Inp | 1605.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1606.00 | NIST | |
| Inp | 1586.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | Outlier 1559.00 | NIST | |
| Inp | 1598.00 | NIST | |
| Inp | 1599.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1601.00 | NIST | |
| Inp | 1603.00 | NIST | |
| Inp | 1607.00 | NIST | |
| Inp | Outlier 1652.00 | NIST | |
| Inp | Outlier 1573.00 | NIST | |
| Inp | 1602.00 | NIST | |
| Inp | 1610.00 | NIST | |
| Inp | Outlier 1575.00 | NIST | |
| Inp | 1593.00 | NIST | |
| Inp | 1596.00 | NIST | |
| Inp | 1597.00 | NIST | |
| Inp | 1599.00 | NIST | |
| I | [2024.00; 2071.00] |
|
|
| I | Outlier 2027.00 | NIST | |
| I | 2044.00 | NIST | |
| I | 2038.00 | NIST | |
| I | 2041.00 | NIST | |
| I | 2048.00 | NIST | |
| I | Outlier 2025.00 | NIST | |
| I | Outlier 2024.00 | NIST | |
| I | 2038.00 | NIST | |
| I | 2040.00 | NIST | |
| I | 2042.00 | NIST | |
| I | 2068.00 | NIST | |
| I | 2066.00 | NIST | |
| I | Outlier 2027.00 | NIST | |
| I | 2040.00 | NIST | |
| I | 2062.00 | NIST | |
| I | Outlier 2026.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2061.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2070.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2069.00 | NIST | |
| I | 2070.00 | NIST | |
| I | 2062.00 | NIST | |
| I | Outlier 2024.00 | NIST | |
| I | 2071.00 | NIST | |
| I | 2070.00 | NIST | |
| I | 2044.00 | NIST | |
| I | Outlier 2024.00 | NIST | |
| I | 2066.00 | NIST | |
| I | 2069.00 | NIST | |
| I | Outlier 2027.00 | NIST |
Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [538.30; 663.63] | J/mol×K | [607.96; 848.58] |
|
| Cp,gas | 538.30 | J/mol×K | 607.96 | Joback Calculated Property |
| Cp,gas | 561.79 | J/mol×K | 648.06 | Joback Calculated Property |
| Cp,gas | 583.86 | J/mol×K | 688.17 | Joback Calculated Property |
| Cp,gas | 604.80 | J/mol×K | 728.27 | Joback Calculated Property |
| Cp,gas | 624.88 | J/mol×K | 768.37 | Joback Calculated Property |
| Cp,gas | 644.40 | J/mol×K | 808.48 | Joback Calculated Property |
| Cp,gas | 663.63 | J/mol×K | 848.58 | Joback Calculated Property |
Similar Compounds
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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Take the time to validate and double check the source of the data.
Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.
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