- InChI
- InChI=1S/C6H13N/c1-5(2)7-6(3)4/h5H,1-4H3
- InChI Key
- UCJOAMOXKLJGST-UHFFFAOYSA-N
- Formula
- C6H13N
- SMILES
- CC(C)=NC(C)C
- Molecular Weight1
- 99.17
- CAS
- 3332-08-9
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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).
- 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 | 0.3196 | Relay (1.0) Calculated Property | |
| ΔfG° | 92.62 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -74.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 33.58 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.40 ± 0.20 | eV | NIST |
| log10WS | -0.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.876 | Crippen Calculated Property | |
| McVol | 101.080 | ml/mol | McGowan Calculated Property |
| Pc | 2811.36 | kPa | Joback Calculated Property |
| Tboil | 352.19 | K | Relay (1.0) Calculated Property |
| Tc | 534.68 | K | Relay (1.0) Calculated Property |
| Tfus | 181.98 | K | Relay (1.0) Calculated Property |
| Vc | 0.381 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Propanamine, N-(1-methylethylidene)-.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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