- InChI
- InChI=1S/C11H16ClN/c1-3-13-9(2)8-10-4-6-11(12)7-5-10/h4-7,9,13H,3,8H2,1-2H3
- InChI Key
- PRKDJWMNZDSUPT-UHFFFAOYSA-N
- Formula
- C11H16ClN
- SMILES
- CCNC(C)Cc1ccc(Cl)cc1
- Molecular Weight1
- 197.70
- Other Names
-
- N-Ethyl-p-chloramphetamine
- Ethyl-p-chloramphetamine
- 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 | 0.4557 | Relay (1.0) Calculated Property | |
| ΔfG° | 219.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -29.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.24 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.880 | Crippen Calculated Property | |
| McVol | 164.310 | ml/mol | McGowan Calculated Property |
| Pc | 2566.29 | kPa | Joback Calculated Property |
| Inp | [1434.00; 1456.00] |
|
|
| Inp | 1434.00 | NIST | |
| Inp | 1456.00 | NIST | |
| Inp | 1456.00 | NIST | |
| Inp | 1434.00 | NIST | |
| I | [1860.00; 1860.00] |
|
|
| I | 1860.00 | NIST | |
| I | 1860.00 | NIST | |
| I | 1860.00 | NIST | |
| Tboil | 530.77 | K | Relay (1.0) Calculated Property |
| Tc | 725.42 | K | Relay (1.0) Calculated Property |
| Tfus | 302.11 | K | Relay (1.0) Calculated Property |
| Vc | 0.579 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [380.16; 458.15] | J/mol×K | [569.90; 783.28] |
|
| Cp,gas | 380.16 | J/mol×K | 569.90 | Joback Calculated Property |
| Cp,gas | 395.29 | J/mol×K | 605.46 | Joback Calculated Property |
| Cp,gas | 409.53 | J/mol×K | 641.03 | Joback Calculated Property |
| Cp,gas | 422.89 | J/mol×K | 676.59 | Joback Calculated Property |
| Cp,gas | 435.42 | J/mol×K | 712.15 | Joback Calculated Property |
| Cp,gas | 447.16 | J/mol×K | 747.71 | Joback Calculated Property |
| Cp,gas | 458.15 | J/mol×K | 783.28 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Ethyl-p-chloro-amphetamine.
Sources
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