- InChI
- InChI=1S/C6H13N/c1-5-2-3-6(7)4-5/h5-6H,2-4,7H2,1H3
- InChI Key
- LGSSDLSVHUCRFI-UHFFFAOYSA-N
- Formula
- C6H13N
- SMILES
- CC1CCC(N)C1
- Molecular Weight1
- 99.17
- CAS
- 52430-83-8
- 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 | 0.3202 | Relay (... Calculated Property | |
| ΔfG° | 94.93 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -77.68 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 11.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.91 | kJ/mol | Relay (... Calculated Property |
| IE | 8.50 | eV | Relay (... Calculated Property |
| log10WS | -1.78 | Relay (... Calculated Property | |
| logPoct/wat | 1.134 | Crippen Calculated Property | |
| McVol | 94.520 | ml/mol | McGowan Calculated Property |
| Pc | 3955.54 | kPa | Joback Calculated Property |
| Inp | [815.00; 815.00] |
|
|
| Inp | 815.00 | NIST | |
| Inp | 815.00 | NIST | |
| Tboil | 389.58 | K | Relay (... Calculated Property |
| Tc | 592.09 | K | Relay (... Calculated Property |
| Tfus | 186.52 | K | Relay (... Calculated Property |
| Vc | 0.332 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [192.87; 271.31] | J/mol×K | [419.82; 631.37] |
|
| Cp,gas | 192.87 | J/mol×K | 419.82 | Joback Calculated Property |
| Cp,gas | 207.77 | J/mol×K | 455.08 | Joback Calculated Property |
| Cp,gas | 221.91 | J/mol×K | 490.34 | Joback Calculated Property |
| Cp,gas | 235.31 | J/mol×K | 525.59 | Joback Calculated Property |
| Cp,gas | 248.00 | J/mol×K | 560.85 | Joback Calculated Property |
| Cp,gas | 259.99 | J/mol×K | 596.11 | Joback Calculated Property |
| Cp,gas | 271.31 | J/mol×K | 631.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentanamine, 3-methyl-.
Sources
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