- InChI
- InChI=1S/C10H19N/c1-2-8-7-11-10-6-4-3-5-9(8)10/h8-11H,2-7H2,1H3
- InChI Key
- POQZASNPVNSKNG-UHFFFAOYSA-N
- Formula
- C10H19N
- SMILES
- CCC1CNC2CCCCC12
- Molecular Weight1
- 153.26
- 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 | 0.3469 | Relay (1.0) Calculated Property | |
| ΔfG° | 198.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -101.39 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.97 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.73 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.65 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.175 | Crippen Calculated Property | |
| McVol | 140.020 | ml/mol | McGowan Calculated Property |
| Pc | 2918.68 | kPa | Joback Calculated Property |
| Inp | [1308.00; 1326.00] |
|
|
| Inp | 1308.00 | NIST | |
| Inp | 1326.00 | NIST | |
| Inp | 1308.00 | NIST | |
| I | [1513.00; 1523.00] |
|
|
| I | 1513.00 | NIST | |
| I | 1523.00 | NIST | |
| Tboil | 488.66 | K | Relay (1.0) Calculated Property |
| Tc | 711.19 | K | Relay (1.0) Calculated Property |
| Tfus | 338.76 | K | Relay (1.0) Calculated Property |
| Vc | 0.486 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [336.39; 446.85] | J/mol×K | [498.37; 717.72] |
|
| Cp,gas | 336.39 | J/mol×K | 498.37 | Joback Calculated Property |
| Cp,gas | 357.70 | J/mol×K | 534.93 | Joback Calculated Property |
| Cp,gas | 377.78 | J/mol×K | 571.49 | Joback Calculated Property |
| Cp,gas | 396.69 | J/mol×K | 608.05 | Joback Calculated Property |
| Cp,gas | 414.48 | J/mol×K | 644.61 | Joback Calculated Property |
| Cp,gas | 431.18 | J/mol×K | 681.16 | Joback Calculated Property |
| Cp,gas | 446.85 | J/mol×K | 717.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-ethyl-octahydroindole.
Sources
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