- InChI
- InChI=1S/C6H10O/c1-4-6(3,7)5-2/h4-5,7H,1-2H2,3H3
- InChI Key
- LNSCVZRMAHCQIH-UHFFFAOYSA-N
- Formula
- C6H10O
- SMILES
- C=CC(C)(O)C=C
- Molecular Weight1
- 98.14
- CAS
- 918-86-5
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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° | 41.34 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -77.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 5.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.99 | kJ/mol | Joback Calculated Property |
| log10WS | -1.42 | Crippen Calculated Property | |
| logPoct/wat | 1.109 | Crippen Calculated Property | |
| McVol | 92.670 | ml/mol | McGowan Calculated Property |
| Pc | 3911.14 | kPa | Joback Calculated Property |
| Inp | [824.00; 824.00] |
|
|
| Inp | 824.00 | NIST | |
| Inp | 824.00 | NIST | |
| Tboil | 418.99 | K | Joback Calculated Property |
| Tc | 597.06 | K | Joback Calculated Property |
| Tfus | 217.10 | K | Joback Calculated Property |
| Vc | 0.342 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [179.23; 227.73] | J/mol×K | [418.99; 597.06] |
|
| Cp,gas | 179.23 | J/mol×K | 418.99 | Joback Calculated Property |
| Cp,gas | 188.60 | J/mol×K | 448.67 | Joback Calculated Property |
| Cp,gas | 197.42 | J/mol×K | 478.35 | Joback Calculated Property |
| Cp,gas | 205.71 | J/mol×K | 508.03 | Joback Calculated Property |
| Cp,gas | 213.51 | J/mol×K | 537.71 | Joback Calculated Property |
| Cp,gas | 220.84 | J/mol×K | 567.39 | Joback Calculated Property |
| Cp,gas | 227.73 | J/mol×K | 597.06 | Joback Calculated Property |
| η | [0.0002774; 0.1123776] | Pa×s | [217.10; 418.99] |
|
| η | 0.1123776 | Pa×s | 217.10 | Joback Calculated Property |
| η | 0.0211100 | Pa×s | 250.75 | Joback Calculated Property |
| η | 0.0058903 | Pa×s | 284.40 | Joback Calculated Property |
| η | 0.0021532 | Pa×s | 318.04 | Joback Calculated Property |
| η | 0.0009542 | Pa×s | 351.69 | Joback Calculated Property |
| η | 0.0004875 | Pa×s | 385.34 | Joback Calculated Property |
| η | 0.0002774 | Pa×s | 418.99 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Methylpenta-1,4-diene-3-ol.
Sources
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