- InChI
- InChI=1S/C8H11N/c1-6-3-7(2)5-8(9)4-6/h3-5H,9H2,1-2H3
- InChI Key
- MKARNSWMMBGSHX-UHFFFAOYSA-N
- Formula
- C8H11N
- SMILES
- Cc1cc(C)cc(N)c1
- Molecular Weight1
- 121.18
- CAS
- 108-69-0
- Other Names
-
- 1-Amino-3,5-dimethylbenzene
- 3,5-Dimethylaniline
- 3,5-Dimethylbenzenamine
- 3,5-Dimethylbenzeneamine
- 3,5-Dimethylphenylamine
- 3,5-Xylidene
- 3,5-Xylidine
- 3,5-Xylylamine
- 5-Amino-1,3-dimethylbenzene
- 5-Amino-1,3-xylene
- NSC 26880
- 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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | 176.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 38.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.64 | kJ/mol | Joback Calculated Property |
| IE | [7.20; 7.75] | eV |
|
| IE | 7.20 | eV | NIST |
| IE | 7.60 ± 0.10 | eV | NIST |
| IE | 7.75 ± 0.05 | eV | NIST |
| log10WS | -2.06 | Crippen Calculated Property | |
| logPoct/wat | 1.886 | Crippen Calculated Property | |
| McVol | 109.800 | ml/mol | McGowan Calculated Property |
| Pc | 3773.04 | kPa | Joback Calculated Property |
| Inp | [198.01; 1177.00] |
|
|
| Inp | 1177.00 | NIST | |
| Inp | 1140.00 | NIST | |
| Inp | 198.01 | NIST | |
| Tboil | 490.55 ± 0.40 | K | NIST |
| Tc | 717.26 | K | Joback Calculated Property |
| Tfus | 283.00 ± 1.00 | K | NIST |
| Vc | 0.405 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [228.80; 292.16] | J/mol×K | [491.61; 717.26] |
|
| Cp,gas | 228.80 | J/mol×K | 491.61 | Joback Calculated Property |
| Cp,gas | 240.98 | J/mol×K | 529.22 | Joback Calculated Property |
| Cp,gas | 252.48 | J/mol×K | 566.83 | Joback Calculated Property |
| Cp,gas | 263.33 | J/mol×K | 604.43 | Joback Calculated Property |
| Cp,gas | 273.54 | J/mol×K | 642.04 | Joback Calculated Property |
| Cp,gas | 283.15 | J/mol×K | 679.65 | Joback Calculated Property |
| Cp,gas | 292.16 | J/mol×K | 717.26 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 377.70 | K | 1.90 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [369.92; 519.78] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.50847e+01 | |||
| Coefficient B | -4.31389e+03 | |||
| Coefficient C | -7.83850e+01 | |||
| Temperature range, min. | 369.92 | |||
| Temperature range, max. | 519.78 | |||
| Pvap | 1.33 | kPa | 369.92 | Calculated Property |
| Pvap | 2.97 | kPa | 386.57 | Calculated Property |
| Pvap | 6.08 | kPa | 403.22 | Calculated Property |
| Pvap | 11.61 | kPa | 419.87 | Calculated Property |
| Pvap | 20.89 | kPa | 436.52 | Calculated Property |
| Pvap | 35.68 | kPa | 453.18 | Calculated Property |
| Pvap | 58.22 | kPa | 469.83 | Calculated Property |
| Pvap | 91.28 | kPa | 486.48 | Calculated Property |
| Pvap | 138.14 | kPa | 503.13 | Calculated Property |
| Pvap | 202.64 | kPa | 519.78 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 3,5-dimethyl-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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