- InChI
- InChI=1S/C16H26O/c1-11(2)13-6-8-16(4)9-7-15(17-5)12(3)14(16)10-13/h6,11,14-15H,3,7-10H2,1-2,4-5H3/t14?,15-,16+/m1/s1
- InChI Key
- LCGAORDNTFSGFT-JAIYHHTPSA-N
- Formula
- C16H26O
- SMILES
-
C=C1C(OC)CCC2(C)CC=C(C(C)C)CC1
2 - Molecular Weight1
- 234.38
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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.
- 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 |
|---|---|---|---|
| ω | 0.3448 | Relay (... Calculated Property | |
| ΔfG° | 109.71 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -203.29 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 17.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.41 | kJ/mol | Relay (... Calculated Property |
| IE | 8.34 | eV | Relay (... Calculated Property |
| log10WS | -4.28 | Relay (... Calculated Property | |
| logPoct/wat | 4.350 | Crippen Calculated Property | |
| McVol | 211.850 | ml/mol | McGowan Calculated Property |
| Pc | 1809.23 | kPa | Joback Calculated Property |
| Inp | [1586.00; 1586.00] |
|
|
| Inp | 1586.00 | NIST | |
| Inp | 1586.00 | NIST | |
| I | 1858.00 | NIST | |
| Tboil | 549.24 | K | Relay (... Calculated Property |
| Tc | 754.77 | K | Relay (... Calculated Property |
| Tfus | 281.65 | K | Relay (... Calculated Property |
| Vc | 0.717 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [583.78; 702.92] | J/mol×K | [616.89; 833.05] |
|
| Cp,gas | 583.78 | J/mol×K | 616.89 | Joback Calculated Property |
| Cp,gas | 606.30 | J/mol×K | 652.92 | Joback Calculated Property |
| Cp,gas | 627.59 | J/mol×K | 688.94 | Joback Calculated Property |
| Cp,gas | 647.78 | J/mol×K | 724.97 | Joback Calculated Property |
| Cp,gas | 666.99 | J/mol×K | 761.00 | Joback Calculated Property |
| Cp,gas | 685.33 | J/mol×K | 797.02 | Joback Calculated Property |
| Cp,gas | 702.92 | J/mol×K | 833.05 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Eudesma-4(15),7-dien-3«beta»-yl methyl ether.
Sources
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