- InChI
- InChI=1S/C16H26O/c1-11(2)13-6-8-16(4)9-7-15(17-5)12(3)14(16)10-13/h10,12,14-15H,1,6-9H2,2-5H3/t12-,14?,15-,16+/m1/s1
- InChI Key
- BZESABUEMVPDAR-OHRKKDJYSA-N
- Formula
- C16H26O
- SMILES
-
C=C(C)C1=CC2C(C)C(OC)CCC2(C)CC
1 - 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.
- 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 | 0.3816 | Relay (1.0) Calculated Property | |
| ΔfG° | 130.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -146.44 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.96 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.19 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.350 | Crippen Calculated Property | |
| McVol | 211.850 | ml/mol | McGowan Calculated Property |
| Pc | 1789.39 | kPa | Joback Calculated Property |
| Inp | [1654.00; 1654.00] |
|
|
| Inp | 1654.00 | NIST | |
| Inp | 1654.00 | NIST | |
| Tboil | 557.85 | K | Relay (1.0) Calculated Property |
| Tc | 767.36 | K | Relay (1.0) Calculated Property |
| Tfus | 317.26 | K | Relay (1.0) Calculated Property |
| Vc | 0.720 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [584.39; 708.25] | J/mol×K | [610.06; 828.08] |
|
| Cp,gas | 584.39 | J/mol×K | 610.06 | Joback Calculated Property |
| Cp,gas | 607.89 | J/mol×K | 646.40 | Joback Calculated Property |
| Cp,gas | 630.08 | J/mol×K | 682.73 | Joback Calculated Property |
| Cp,gas | 651.09 | J/mol×K | 719.07 | Joback Calculated Property |
| Cp,gas | 671.03 | J/mol×K | 755.41 | Joback Calculated Property |
| Cp,gas | 690.04 | J/mol×K | 791.74 | Joback Calculated Property |
| Cp,gas | 708.25 | J/mol×K | 828.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-«beta»-H-cis-Eudesma-6,11-dien-3-«beta»-yl methyl ether.
Sources
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