- InChI
- InChI=1S/C9H13N/c1-8-2-4-9(5-3-8)6-7-10/h2-5H,6-7,10H2,1H3
- InChI Key
- VKJXAQYPOTYDLO-UHFFFAOYSA-N
- Formula
- C9H13N
- SMILES
- Cc1ccc(CCN)cc1
- Molecular Weight1
- 135.21
- CAS
- 3261-62-9
- Other Names
-
- Benzeneethanamine, 4-methyl-
- p-methylphenethylamine
- 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).
- 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 | 0.4914 | Relay (1.0) Calculated Property | |
| ΔfG° | 194.13 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 22.96 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.51 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.25 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.496 | Crippen Calculated Property | |
| McVol | 123.890 | ml/mol | McGowan Calculated Property |
| Pc | 3423.86 | kPa | Joback Calculated Property |
| Tboil | 487.20 | K | NIST |
| Tc | 706.38 | K | Relay (1.0) Calculated Property |
| Tfus | 326.89 | K | Relay (1.0) Calculated Property |
| Vc | 0.441 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [271.53; 342.28] | J/mol×K | [509.51; 730.11] | 
|
| Cp,gas | 271.53 | J/mol×K | 509.51 | Joback Calculated Property |
| Cp,gas | 285.22 | J/mol×K | 546.28 | Joback Calculated Property |
| Cp,gas | 298.11 | J/mol×K | 583.04 | Joback Calculated Property |
| Cp,gas | 310.23 | J/mol×K | 619.81 | Joback Calculated Property |
| Cp,gas | 321.61 | J/mol×K | 656.58 | Joback Calculated Property |
| Cp,gas | 332.28 | J/mol×K | 693.35 | Joback Calculated Property |
| Cp,gas | 342.28 | J/mol×K | 730.11 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-(p-Tolyl)ethylamine.
Sources
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