- InChI
- InChI=1S/C17H24O3/c1-10-5-6-16(20-12(3)18)17(4)8-15-13(7-14(10)17)11(2)9-19-15/h5,9,13-16H,6-8H2,1-4H3/t13?,14?,15?,16-,17+/m1/s1
- InChI Key
- YXXLPORTKKMOGV-PPRXNKMGSA-N
- Formula
- C17H24O3
- SMILES
-
CC(=O)OC1CC=C(C)C2CC3C(C)=COC3
CC12C - Molecular Weight1
- 276.37
- 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).
- I : 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° | -74.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -510.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.67 | kJ/mol | Joback Calculated Property |
| log10WS | -4.27 | Crippen Calculated Property | |
| logPoct/wat | 3.603 | Crippen Calculated Property | |
| McVol | 222.520 | ml/mol | McGowan Calculated Property |
| Pc | 1887.08 | kPa | Joback Calculated Property |
| I | 2730.00 | NIST | |
| Tboil | 728.08 | K | Joback Calculated Property |
| Tc | 955.13 | K | Joback Calculated Property |
| Tfus | 461.80 | K | Joback Calculated Property |
| Vc | 0.840 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [689.45; 801.52] | J/mol×K | [728.08; 955.13] | 
|
| Cp,gas | 689.45 | J/mol×K | 728.08 | Joback Calculated Property |
| Cp,gas | 710.11 | J/mol×K | 765.92 | Joback Calculated Property |
| Cp,gas | 729.77 | J/mol×K | 803.76 | Joback Calculated Property |
| Cp,gas | 748.57 | J/mol×K | 841.60 | Joback Calculated Property |
| Cp,gas | 766.70 | J/mol×K | 879.45 | Joback Calculated Property |
| Cp,gas | 784.29 | J/mol×K | 917.29 | Joback Calculated Property |
| Cp,gas | 801.52 | J/mol×K | 955.13 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1«beta»-acetoxyfurano-3-eudesmene.
Sources
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