- InChI
- InChI=1S/C11H20O/c1-9(2)6-5-7-10(3)8-11(4)12/h6,8,11-12H,5,7H2,1-4H3/b10-8+
- InChI Key
- NYPOJSCNHYUZRG-CSKARUKUSA-N
- Formula
- C11H20O
- SMILES
- CC(C)=CCCC(C)=CC(C)O
- Molecular Weight1
- 168.28
- CAS
- 67845-50-5
- Other Names
-
- 4,8-Dimethyl-3,7-nonadien-2-ol
- 4,8-Dimethylnona-3,7-dien-2-ol
- 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.
- I : 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 | 0.5755 | Relay (1.0) Calculated Property | |
| ΔfG° | 45.82 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -299.93 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.89 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.54 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.50 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.060 | Crippen Calculated Property | |
| McVol | 163.120 | ml/mol | McGowan Calculated Property |
| Pc | 2356.49 | kPa | Joback Calculated Property |
| Inp | 1329.00 | NIST | |
| I | [1311.00; 1311.00] |
|
|
| I | 1311.00 | NIST | |
| I | 1311.00 | NIST | |
| Tboil | 495.69 | K | Relay (1.0) Calculated Property |
| Tc | 663.79 | K | Relay (1.0) Calculated Property |
| Tfus | 264.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.585 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [391.66; 465.08] | J/mol×K | [550.90; 729.66] |
|
| Cp,gas | 391.66 | J/mol×K | 550.90 | Joback Calculated Property |
| Cp,gas | 405.48 | J/mol×K | 580.69 | Joback Calculated Property |
| Cp,gas | 418.62 | J/mol×K | 610.49 | Joback Calculated Property |
| Cp,gas | 431.12 | J/mol×K | 640.28 | Joback Calculated Property |
| Cp,gas | 443.00 | J/mol×K | 670.08 | Joback Calculated Property |
| Cp,gas | 454.31 | J/mol×K | 699.87 | Joback Calculated Property |
| Cp,gas | 465.08 | J/mol×K | 729.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3,7-Nonadien-2-ol, 4,8-dimethyl-.
Sources
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