- InChI
- InChI=1S/C11H15N/c12-11-8-4-7-10(11)9-5-2-1-3-6-9/h1-3,5-6,10-11H,4,7-8,12H2
- InChI Key
- VNGYTYNUZHDMPP-UHFFFAOYSA-N
- Formula
- C11H15N
- SMILES
- NC1CCCC1c1ccccc1
- Molecular Weight1
- 161.24
- CAS
- 5588-23-8
- 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.
- 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 |
|---|---|---|---|
| ΔfG° | 249.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 40.09 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 18.49 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.94 | kJ/mol | Joback Calculated Property |
| log10WS | -2.93 | Crippen Calculated Property | |
| logPoct/wat | 2.281 | Crippen Calculated Property | |
| McVol | 141.210 | ml/mol | McGowan Calculated Property |
| Pc | 3306.75 | kPa | Joback Calculated Property |
| Inp | [1405.00; 1460.00] |
|
|
| Inp | 1405.00 | NIST | |
| Inp | 1419.00 | NIST | |
| Inp | 1428.00 | NIST | |
| Inp | 1453.00 | NIST | |
| Inp | 1456.00 | NIST | |
| Inp | 1460.00 | NIST | |
| Inp | 1405.00 | NIST | |
| Inp | 1460.00 | NIST | |
| I | [1966.00; 2030.00] |
|
|
| I | 1966.00 | NIST | |
| I | 1976.00 | NIST | |
| I | 1989.00 | NIST | |
| I | 2014.00 | NIST | |
| I | 2022.00 | NIST | |
| I | 2030.00 | NIST | |
| Tboil | 560.90 | K | Joback Calculated Property |
| Tc | 806.64 | K | Joback Calculated Property |
| Tfus | 330.07 | K | Joback Calculated Property |
| Vc | 0.512 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [351.34; 446.73] | J/mol×K | [560.90; 806.64] |
|
| Cp,gas | 351.34 | J/mol×K | 560.90 | Joback Calculated Property |
| Cp,gas | 370.52 | J/mol×K | 601.86 | Joback Calculated Property |
| Cp,gas | 388.29 | J/mol×K | 642.81 | Joback Calculated Property |
| Cp,gas | 404.73 | J/mol×K | 683.77 | Joback Calculated Property |
| Cp,gas | 419.91 | J/mol×K | 724.73 | Joback Calculated Property |
| Cp,gas | 433.88 | J/mol×K | 765.68 | Joback Calculated Property |
| Cp,gas | 446.73 | J/mol×K | 806.64 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cypenamine.
Sources
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