- InChI
- InChI=1S/C9H18/c1-3-9-6-4-8(2)5-7-9/h8-9H,3-7H2,1-2H3
- InChI Key
- CYISMTMRBPPERU-UHFFFAOYSA-N
- Formula
- C9H18
- SMILES
- CCC1CCC(C)CC1
- Molecular Weight1
- 126.24
- CAS
- 3728-56-1
- ω : Acentric Factor.
- 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).
- 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 | 0.2734 | Relay (1.0) Calculated Property | |
| ΔfG° | 41.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -185.24 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.23 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.93 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.223 | Crippen Calculated Property | |
| McVol | 126.810 | ml/mol | McGowan Calculated Property |
| Pc | 2741.15 | kPa | Joback Calculated Property |
| Inp | [883.00; 888.00] |
|
|
| Inp | 888.00 | NIST | |
| Inp | 883.00 | NIST | |
| Inp | 888.00 | NIST | |
| Inp | 883.00 | NIST | |
| Tboil | [420.00; 423.70] | K |
|
| Tboil | 423.70 ± 2.00 | K | NIST |
| Tboil | 420.00 ± 3.00 | K | NIST |
| Tboil | 423.00 ± 4.00 | K | NIST |
| Tc | 613.46 | K | Relay (1.0) Calculated Property |
| Tfus | 178.45 | K | Relay (1.0) Calculated Property |
| Vc | 0.459 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [255.18; 355.89] | J/mol×K | [420.40; 619.00] |
|
| Cp,gas | 255.18 | J/mol×K | 420.40 | Joback Calculated Property |
| Cp,gas | 274.03 | J/mol×K | 453.50 | Joback Calculated Property |
| Cp,gas | 292.02 | J/mol×K | 486.60 | Joback Calculated Property |
| Cp,gas | 309.19 | J/mol×K | 519.70 | Joback Calculated Property |
| Cp,gas | 325.55 | J/mol×K | 552.80 | Joback Calculated Property |
| Cp,gas | 341.11 | J/mol×K | 585.90 | Joback Calculated Property |
| Cp,gas | 355.89 | J/mol×K | 619.00 | Joback Calculated Property |
| η | [0.0002665; 0.0046654] | Pa×s | [194.33; 420.40] |
|
| η | 0.0046654 | Pa×s | 194.33 | Joback Calculated Property |
| η | 0.0019654 | Pa×s | 232.01 | Joback Calculated Property |
| η | 0.0010542 | Pa×s | 269.69 | Joback Calculated Property |
| η | 0.0006587 | Pa×s | 307.37 | Joback Calculated Property |
| η | 0.0004561 | Pa×s | 345.04 | Joback Calculated Property |
| η | 0.0003396 | Pa×s | 382.72 | Joback Calculated Property |
| η | 0.0002665 | Pa×s | 420.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Ethyl-4-methylcyclohexane.
Sources
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