- InChI
- InChI=1S/C9H13N/c1-6-4-8(3)9(10)5-7(6)2/h4-5H,10H2,1-3H3
- InChI Key
- BMIPMKQAAJKBKP-UHFFFAOYSA-N
- Formula
- C9H13N
- SMILES
- Cc1cc(C)c(N)cc1C
- Molecular Weight1
- 135.21
- CAS
- 137-17-7
- Other Names
-
- 1,2,4-Trimethyl-5-aminobenzene
- 1-Amino-2,4,5-trimethylbenzene
- 2,4,5-Trimethylanilin
- 2,4,5-Trimethylaniline
- 2,4,5-Trimethylbenzenamine
- 2,4,5-Trimethylphenylamine
- Aniline, 2,4,5-trimethyl-
- NCI-C02299
- NSC 37004
- Pseudocumidine
- Pseudokumidin
- psi-Cumidine
- «psi»-Cumidine
- «psi»-Cumidine
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -5318.70 | kJ/mol | NIST |
| ΔfG° | 174.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 6.82 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | -110.00 | kJ/mol | NIST |
| ΔfusH° | 17.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.53 | kJ/mol | Joback Calculated Property |
| 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 | 220.25 | NIST | |
| Tboil | 507.70 | K | NIST |
| Tc | 742.49 | K | Joback Calculated Property |
| Tfus | 338.43 | K | Joback Calculated Property |
| 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 |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [0.14; 202.65] | kPa | [341.15; 538.64] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.48428e+01 | |||
| Coefficient B | -4.34972e+03 | |||
| Coefficient C | -8.22770e+01 | |||
| Temperature range, min. | 341.15 | |||
| Temperature range, max. | 538.64 | |||
| Pvap | 0.14 | kPa | 341.15 | Calculated Property |
| Pvap | 0.52 | kPa | 363.09 | Calculated Property |
| Pvap | 1.61 | kPa | 385.04 | Calculated Property |
| Pvap | 4.25 | kPa | 406.98 | Calculated Property |
| Pvap | 9.92 | kPa | 428.92 | Calculated Property |
| Pvap | 20.94 | kPa | 450.87 | Calculated Property |
| Pvap | 40.64 | kPa | 472.81 | Calculated Property |
| Pvap | 73.51 | kPa | 494.75 | Calculated Property |
| Pvap | 125.22 | kPa | 516.70 | Calculated Property |
| Pvap | 202.65 | kPa | 538.64 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 2,4,5-trimethyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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