- InChI
- InChI=1S/C15H26O/c1-10(2)12-7-8-15(4)13(12)9-11(3)5-6-14(15)16/h10,12-14,16H,3,5-9H2,1-2,4H3/t12-,13?,14?,15+/m1/s1
- InChI Key
- ZDBGOUZSMNLRKJ-URGYJCLVSA-N
- Formula
- C15H26O
- SMILES
- C=C1CCC(O)C2(C)CCC(C(C)C)C2C1
- Molecular Weight1
- 222.37
- 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).
- 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° | 41.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -330.68 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.18 | kJ/mol | Joback Calculated Property |
| log10WS | -4.15 | Crippen Calculated Property | |
| logPoct/wat | 3.776 | Crippen Calculated Property | |
| McVol | 202.060 | ml/mol | McGowan Calculated Property |
| Pc | 2066.12 | kPa | Joback Calculated Property |
| Inp | [1584.00; 1584.00] |
|
|
| Inp | 1584.00 | NIST | |
| Inp | 1584.00 | NIST | |
| Tboil | 654.96 | K | Joback Calculated Property |
| Tc | 859.10 | K | Joback Calculated Property |
| Tfus | 355.53 | K | Joback Calculated Property |
| Vc | 0.750 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [596.74; 704.61] | J/mol×K | [654.96; 859.10] |
|
| Cp,gas | 596.74 | J/mol×K | 654.96 | Joback Calculated Property |
| Cp,gas | 616.91 | J/mol×K | 688.98 | Joback Calculated Property |
| Cp,gas | 636.06 | J/mol×K | 723.01 | Joback Calculated Property |
| Cp,gas | 654.29 | J/mol×K | 757.03 | Joback Calculated Property |
| Cp,gas | 671.72 | J/mol×K | 791.05 | Joback Calculated Property |
| Cp,gas | 688.46 | J/mol×K | 825.08 | Joback Calculated Property |
| Cp,gas | 704.61 | J/mol×K | 859.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Salvia-4(14)-en-1-ol.
Sources
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