- InChI
- InChI=1S/C18H26/c1-14(2)7-6-8-15(3)9-11-18-12-10-16(4)17(5)13-18/h7,9-10,12-13H,6,8,11H2,1-5H3/b15-9+
- InChI Key
- IXKLZDQUHVBMOI-OQLLNIDSSA-N
- Formula
- C18H26
- SMILES
- CC(C)=CCCC(C)=CCc1ccc(C)c(C)c1
- Molecular Weight1
- 242.40
- 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 | 0.5125 | Relay (1.0) Calculated Property | |
| ΔfG° | 337.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -34.09 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 33.42 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.87 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.85 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.31 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.539 | Crippen Calculated Property | |
| McVol | 232.120 | ml/mol | McGowan Calculated Property |
| Pc | 1561.05 | kPa | Joback Calculated Property |
| Inp | [818.00; 835.00] |
|
|
| Inp | 818.00 | NIST | |
| Inp | 835.00 | NIST | |
| Inp | 818.00 | NIST | |
| Tboil | 593.07 | K | Relay (1.0) Calculated Property |
| Tc | 768.66 | K | Relay (1.0) Calculated Property |
| Tfus | 263.52 | K | Relay (1.0) Calculated Property |
| Vc | 0.842 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [611.31; 711.15] | J/mol×K | [655.96; 863.25] |
|
| Cp,gas | 611.31 | J/mol×K | 655.96 | Joback Calculated Property |
| Cp,gas | 630.41 | J/mol×K | 690.51 | Joback Calculated Property |
| Cp,gas | 648.43 | J/mol×K | 725.06 | Joback Calculated Property |
| Cp,gas | 665.45 | J/mol×K | 759.60 | Joback Calculated Property |
| Cp,gas | 681.53 | J/mol×K | 794.15 | Joback Calculated Property |
| Cp,gas | 696.74 | J/mol×K | 828.70 | Joback Calculated Property |
| Cp,gas | 711.15 | J/mol×K | 863.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to o-xylene geranium.
Sources
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