- InChI
- InChI=1S/C15H24O2/c1-6-12(3)14(16)17-15(4,5)13-9-7-11(2)8-10-13/h6-7,13H,8-10H2,1-5H3/b12-6+
- InChI Key
- XMZRVZZNEWGJSP-WUXMJOGZSA-N
- Formula
- C15H24O2
- SMILES
-
CC=C(C)C(=O)OC(C)(C)C1CC=C(C)C
C1 - Molecular Weight1
- 236.35
- Other Names
-
- «alpha»-Terpinyl tiglate
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -39.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -398.42 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.27 | kJ/mol | Joback Calculated Property |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 4.021 | Crippen Calculated Property | |
| McVol | 210.190 | ml/mol | McGowan Calculated Property |
| Pc | 1874.03 | kPa | Joback Calculated Property |
| Inp | [1588.00; 1588.00] |
|
|
| Inp | 1588.00 | NIST | |
| Inp | 1588.00 | NIST | |
| Tboil | 643.39 | K | Joback Calculated Property |
| Tc | 859.48 | K | Joback Calculated Property |
| Tfus | 335.01 | K | Joback Calculated Property |
| Vc | 0.788 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [574.23; 675.57] | J/mol×K | [643.39; 859.48] |
|
| Cp,gas | 574.23 | J/mol×K | 643.39 | Joback Calculated Property |
| Cp,gas | 594.08 | J/mol×K | 679.40 | Joback Calculated Property |
| Cp,gas | 612.66 | J/mol×K | 715.42 | Joback Calculated Property |
| Cp,gas | 630.04 | J/mol×K | 751.43 | Joback Calculated Property |
| Cp,gas | 646.28 | J/mol×K | 787.45 | Joback Calculated Property |
| Cp,gas | 661.44 | J/mol×K | 823.46 | Joback Calculated Property |
| Cp,gas | 675.57 | J/mol×K | 859.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Menth-1-en-9-yl tiglate, p-.
Sources
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