- InChI
- InChI=1S/C10H18/c1-8(2)6-7-10(5)9(3)4/h6,10H,3,7H2,1-2,4-5H3
- InChI Key
- CHGRWGYJOYKPSL-UHFFFAOYSA-N
- Formula
- C10H18
- SMILES
- C=C(C)C(C)CC=C(C)C
- Molecular Weight1
- 138.25
- CAS
- 33501-88-1
- Other Names
-
- 2,3,6-Trimethyl-1,5-heptadiene
- 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° | 181.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -31.94 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 36.91 | kJ/mol | Joback Calculated Property |
| log10WS | -3.47 | Crippen Calculated Property | |
| logPoct/wat | 3.555 | Crippen Calculated Property | |
| McVol | 143.160 | ml/mol | McGowan Calculated Property |
| Pc | 2342.82 | kPa | Joback Calculated Property |
| Inp | 1063.00 | NIST | |
| Tboil | 428.36 | K | Joback Calculated Property |
| Tc | 612.80 | K | Joback Calculated Property |
| Tfus | 152.70 | K | Joback Calculated Property |
| Vc | 0.552 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [283.95; 365.68] | J/mol×K | [428.36; 612.80] | 
|
| Cp,gas | 283.95 | J/mol×K | 428.36 | Joback Calculated Property |
| Cp,gas | 299.33 | J/mol×K | 459.10 | Joback Calculated Property |
| Cp,gas | 313.96 | J/mol×K | 489.84 | Joback Calculated Property |
| Cp,gas | 327.88 | J/mol×K | 520.58 | Joback Calculated Property |
| Cp,gas | 341.12 | J/mol×K | 551.32 | Joback Calculated Property |
| Cp,gas | 353.71 | J/mol×K | 582.06 | Joback Calculated Property |
| Cp,gas | 365.68 | J/mol×K | 612.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,5-Heptadiene, 2,3,6-trimethyl-.
Sources
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