- InChI
- InChI=1S/C10H14O2/c1-7-3-4-9(8(2)5-11)10(7)6-12/h5-7,9-10H,2-4H2,1H3/t7-,9?,10?/m0/s1
- InChI Key
- BORBLDJNKYHVJP-WFRXLMHJSA-N
- Formula
- C10H14O2
- SMILES
- C=C(C=O)C1CCC(C)C1C=O
- Molecular Weight1
- 166.22
- 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° | -65.30 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -285.45 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.34 | kJ/mol | Joback Calculated Property |
| log10WS | -1.59 | Crippen Calculated Property | |
| logPoct/wat | 1.603 | Crippen Calculated Property | |
| McVol | 139.740 | ml/mol | McGowan Calculated Property |
| Pc | 2862.74 | kPa | Joback Calculated Property |
| Inp | [1164.00; 1164.00] |
|
|
| Inp | 1164.00 | NIST | |
| Inp | 1164.00 | NIST | |
| Tboil | 528.02 | K | Joback Calculated Property |
| Tc | 734.55 | K | Joback Calculated Property |
| Tfus | 273.16 | K | Joback Calculated Property |
| Vc | 0.550 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [335.76; 417.81] | J/mol×K | [528.02; 734.55] |
|
| Cp,gas | 335.76 | J/mol×K | 528.02 | Joback Calculated Property |
| Cp,gas | 351.54 | J/mol×K | 562.44 | Joback Calculated Property |
| Cp,gas | 366.44 | J/mol×K | 596.86 | Joback Calculated Property |
| Cp,gas | 380.49 | J/mol×K | 631.28 | Joback Calculated Property |
| Cp,gas | 393.72 | J/mol×K | 665.70 | Joback Calculated Property |
| Cp,gas | 406.15 | J/mol×K | 700.13 | Joback Calculated Property |
| Cp,gas | 417.81 | J/mol×K | 734.55 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dolichodial.
Sources
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