- InChI
- InChI=1S/C9H13N/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,10H2,1-3H3
- InChI Key
- KWVPRPSXBZNOHS-UHFFFAOYSA-N
- Formula
- C9H13N
- SMILES
- Cc1cc(C)c(N)c(C)c1
- Molecular Weight1
- 135.21
- CAS
- 88-05-1
- Other Names
-
- 1-Amino-2,4,6-trimethylbenzene
- 2,4,6-Trimethylaniline
- 2,4,6-Trimethylbenzenamine
- 2,4,6-Trimethylphenylamine
- 2-Amino-1,3,5-trimethylbenzene
- 2-Aminomesitylene
- Aminomesitylene
- Aniline, 2,4,6-trimethyl-
- Benzeneamine, 2,4,6-trimethyl-
- Mesidin
- Mesidine
- Mesitylamine
- Mesitylene, 2-amino-
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor 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 |
|---|---|---|---|
| ΔfG° | 174.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 6.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.53 | kJ/mol | Joback Calculated Property |
| IE | [7.15; 7.24] | eV |
|
| IE | 7.15 | eV | NIST |
| IE | 7.24 | eV | NIST |
| log10WS | -2.53 | Crippen Calculated Property | |
| logPoct/wat | 2.194 | Crippen Calculated Property | |
| McVol | 123.890 | ml/mol | McGowan Calculated Property |
| Pc | 3306.75 | kPa | Joback Calculated Property |
| Inp | [214.41; 1261.00] |
|
|
| Inp | 1242.20 | NIST | |
| Inp | 1261.00 | NIST | |
| Inp | 1230.90 | NIST | |
| Inp | 1261.00 | NIST | |
| Inp | 214.41 | NIST | |
| Inp | 214.41 | NIST | |
| Tboil | 505.70 | K | NIST |
| Tc | 742.49 | K | Joback Calculated Property |
| Tfus | 268.25 ± 0.40 | K | NIST |
| Vc | 0.461 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [271.32; 339.30] | J/mol×K | [519.47; 742.49] |
|
| Cp,gas | 271.32 | J/mol×K | 519.47 | Joback Calculated Property |
| Cp,gas | 284.27 | J/mol×K | 556.64 | Joback Calculated Property |
| Cp,gas | 296.55 | J/mol×K | 593.81 | Joback Calculated Property |
| Cp,gas | 308.17 | J/mol×K | 630.98 | Joback Calculated Property |
| Cp,gas | 319.16 | J/mol×K | 668.15 | Joback Calculated Property |
| Cp,gas | 329.53 | J/mol×K | 705.32 | Joback Calculated Property |
| Cp,gas | 339.30 | J/mol×K | 742.49 | Joback Calculated Property |
| ΔvapH | 64.10 | kJ/mol | 425.50 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [379.52; 536.54] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.48394e+01 | |||
| Coefficient B | -4.33350e+03 | |||
| Coefficient C | -8.17210e+01 | |||
| Temperature range, min. | 379.52 | |||
| Temperature range, max. | 536.54 | |||
| Pvap | 1.33 | kPa | 379.52 | Calculated Property |
| Pvap | 2.98 | kPa | 396.97 | Calculated Property |
| Pvap | 6.13 | kPa | 414.41 | Calculated Property |
| Pvap | 11.74 | kPa | 431.86 | Calculated Property |
| Pvap | 21.12 | kPa | 449.31 | Calculated Property |
| Pvap | 36.03 | kPa | 466.75 | Calculated Property |
| Pvap | 58.69 | kPa | 484.20 | Calculated Property |
| Pvap | 91.81 | kPa | 501.65 | Calculated Property |
| Pvap | 138.56 | kPa | 519.09 | Calculated Property |
| Pvap | 202.63 | kPa | 536.54 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 2,4,6-trimethyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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