- InChI
- InChI=1S/C10H18O2/c1-5-10(4)8(11)6-7-9(2,3)12-10/h5,8,11H,1,6-7H2,2-4H3/t8-,10+/m1/s1
- InChI Key
- JRSMRFHLUZKHCR-SCZZXKLOSA-N
- Formula
- C10H18O2
- SMILES
- C=CC1(C)OC(C)(C)CCC1O
- Molecular Weight1
- 170.25
- 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 | 0.4411 | Relay (... Calculated Property | |
| ΔfG° | -103.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -400.97 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 13.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.38 | kJ/mol | Relay (... Calculated Property |
| IE | 8.99 | eV | Relay (... Calculated Property |
| log10WS | -0.74 | Relay (... Calculated Property | |
| logPoct/wat | 1.881 | Crippen Calculated Property | |
| McVol | 148.340 | ml/mol | McGowan Calculated Property |
| Pc | 3005.73 | kPa | Joback Calculated Property |
| Inp | [1155.00; 1157.00] |
|
|
| Inp | 1157.00 | NIST | |
| Inp | 1155.00 | NIST | |
| Inp | 1157.00 | NIST | |
| Tboil | 487.94 | K | Relay (... Calculated Property |
| Tc | 676.41 | K | Relay (... Calculated Property |
| Tfus | 281.59 | K | Relay (... Calculated Property |
| Vc | 0.537 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [381.60; 463.72] | J/mol×K | [554.70; 757.96] |
|
| Cp,gas | 381.60 | J/mol×K | 554.70 | Joback Calculated Property |
| Cp,gas | 397.07 | J/mol×K | 588.58 | Joback Calculated Property |
| Cp,gas | 411.62 | J/mol×K | 622.45 | Joback Calculated Property |
| Cp,gas | 425.40 | J/mol×K | 656.33 | Joback Calculated Property |
| Cp,gas | 438.57 | J/mol×K | 690.21 | Joback Calculated Property |
| Cp,gas | 451.29 | J/mol×K | 724.08 | Joback Calculated Property |
| Cp,gas | 463.72 | J/mol×K | 757.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Linalool oxide, pyran, (E)-.
Sources
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