- InChI
- InChI=1S/C7H9N/c1-6-3-2-4-7(8)5-6/h2-5H,8H2,1H3
- InChI Key
- JJYPMNFTHPTTDI-UHFFFAOYSA-N
- Formula
- C7H9N
- SMILES
- Cc1cccc(N)c1
- Molecular Weight1
- 107.15
- CAS
- 108-44-1
- Other Names
-
- 1-Amino-3-methylbenzene
- 3-Amino-1-methylbenzene
- 3-Aminophenylmethane
- 3-Aminotoluen
- 3-Aminotoluene
- 3-METHYLBENZENEAMINE
- 3-Methylaniline
- 3-Methylbenzenamine
- 3-Toluidine
- 3-methyl-benzamine
- Aniline, 3-methyl-
- M-AMINOTOLUENE
- M-METHYLANILINE
- NSC 15349
- benzeneamine, 3-methyl-
- m-Methylbenzenamine
- m-Toluidin
- m-Toluidine
- m-Tolylamine
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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°liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (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.
- I : Polar retention indices.
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- csound,fluid : Speed of sound in fluid (m/s).
- 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 |
|---|---|---|---|
| PAff | 895.80 | kJ/mol | NIST |
| BasG | 864.00 | kJ/mol | NIST |
| ΔcH°liquid | [-4083.00; -4047.00] | kJ/mol |
|
| ΔcH°liquid | -4083.00 | kJ/mol | NIST |
| ΔcH°liquid | -4047.00 | kJ/mol | NIST |
| ΔfG° | 177.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | [61.10; 87.90] | kJ/mol |
|
| ΔfH°gas | 61.10 | kJ/mol | NIST |
| ΔfH°gas | 87.90 | kJ/mol | NIST |
| ΔfH°liquid | 42.30 | kJ/mol | NIST |
| ΔfusH° | 12.73 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [45.61; 64.10] | kJ/mol |
|
| ΔvapH° | 58.30 ± 0.40 | kJ/mol | NIST |
| ΔvapH° | 59.60 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 62.70 ± 0.50 | kJ/mol | NIST |
| ΔvapH° | Outlier 45.61 | kJ/mol | NIST |
| ΔvapH° | 64.10 | kJ/mol | NIST |
| ΔvapH° | 56.40 | kJ/mol | NIST |
| IE | [7.50; 7.82] | eV |
|
| IE | 7.54 ± 0.03 | eV | NIST |
| IE | 7.55 | eV | NIST |
| IE | 7.70 ± 0.10 | eV | NIST |
| IE | 7.60 ± 0.10 | eV | NIST |
| IE | 7.75 | eV | NIST |
| IE | 7.50 ± 0.02 | eV | NIST |
| IE | 7.82 | eV | NIST |
| IE | 7.66 | eV | NIST |
| IE | 7.66 | eV | NIST |
| log10WS | [-0.85; -0.85] |
|
|
| log10WS | -0.85 | Aq. Sol... | |
| log10WS | -0.85 | Estimat... | |
| logPoct/wat | 1.577 | Crippen Calculated Property | |
| McVol | 95.710 | ml/mol | McGowan Calculated Property |
| Pc | [4154.33; 4280.00] | kPa |
|
| Pc | 4280.00 | kPa | KDB |
| Pc | 4154.33 ± 303.98 | kPa | NIST |
| Inp | [177.34; 1088.00] |
|
|
| Inp | 1088.00 | NIST | |
| Inp | 1088.00 | NIST | |
| Inp | 1082.00 | NIST | |
| Inp | 1047.50 | NIST | |
| Inp | 1064.00 | NIST | |
| Inp | 1075.00 | NIST | |
| Inp | 1074.00 | NIST | |
| Inp | 1064.00 | NIST | |
| Inp | 1060.00 | NIST | |
| Inp | 1060.00 | NIST | |
| Inp | 1043.00 | NIST | |
| Inp | Outlier 177.34 | NIST | |
| Inp | 1088.00 | NIST | |
| Inp | 1074.00 | NIST | |
| Inp | 1082.00 | NIST | |
| Inp | 1060.00 | NIST | |
| Inp | Outlier 177.34 | NIST | |
| I | [1831.00; 1853.00] |
|
|
| I | 1840.00 | NIST | |
| I | 1835.00 | NIST | |
| I | 1840.00 | NIST | |
| I | 1838.00 | NIST | |
| I | 1853.00 | NIST | |
| I | 1831.00 | NIST | |
| I | 1849.00 | NIST | |
| I | 1831.00 | NIST | |
| I | 1840.00 | NIST | |
| Tboil | [471.90; 476.55] | K |
|
| Tboil | 476.52 | K | KDB |
| Tboil | 476.50 | K | NIST |
| Tboil | Outlier 471.90 ± 0.50 | K | NIST |
| Tboil | 476.49 ± 0.07 | K | NIST |
| Tboil | 476.25 ± 0.40 | K | NIST |
| Tboil | 476.25 ± 0.30 | K | NIST |
| Tboil | 476.55 ± 0.30 | K | NIST |
| Tboil | 476.15 ± 0.50 | K | NIST |
| Tboil | 476.35 ± 0.30 | K | NIST |
| Tboil | 476.01 ± 0.20 | K | NIST |
| Tboil | 476.40 ± 0.50 | K | NIST |
| Tboil | 476.30 ± 0.40 | K | NIST |
| Tboil | Outlier 472.20 ± 1.00 | K | NIST |
| Tboil | 476.15 ± 1.00 | K | NIST |
| Tc | [707.00; 709.15] | K |
|
| Tc | 707.00 | K | KDB |
| Tc | 709.15 ± 2.00 | K | NIST |
| Tfus | [229.60; 242.80] | K |
|
| Tfus | 241.90 | K | KDB |
| Tfus | 242.72 | K | Aq. Sol... |
| Tfus | 242.00 ± 0.30 | K | NIST |
| Tfus | 242.80 ± 0.02 | K | NIST |
| Tfus | Outlier 229.60 ± 0.60 | K | NIST |
| Tfus | 241.90 ± 0.30 | K | NIST |
| Tfus | 242.75 ± 0.05 | K | NIST |
| Tfus | 241.90 ± 0.10 | K | NIST |
| Tfus | 241.70 ± 1.50 | K | NIST |
| Tfus | 241.70 ± 0.50 | K | NIST |
| Tfus | 242.15 ± 0.40 | K | NIST |
| Vc | 0.348 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [188.04; 246.42] | J/mol×K | [463.75; 691.81] |
|
| Cp,gas | 188.04 | J/mol×K | 463.75 | Joback Calculated Property |
| Cp,gas | 199.40 | J/mol×K | 501.76 | Joback Calculated Property |
| Cp,gas | 210.07 | J/mol×K | 539.77 | Joback Calculated Property |
| Cp,gas | 220.08 | J/mol×K | 577.78 | Joback Calculated Property |
| Cp,gas | 229.46 | J/mol×K | 615.79 | Joback Calculated Property |
| Cp,gas | 238.23 | J/mol×K | 653.80 | Joback Calculated Property |
| Cp,gas | 246.42 | J/mol×K | 691.81 | Joback Calculated Property |
| Cp,liquid | [167.20; 216.70] | J/mol×K | [302.70; 303.15] |
|
| Cp,liquid | 216.70 | J/mol×K | 302.70 | NIST |
| Cp,liquid | 216.70 | J/mol×K | 302.70 | NIST |
| Cp,liquid | 167.20 | J/mol×K | 303.15 | NIST |
| ΔfusH | [8.80; 8.80] | kJ/mol | [241.65; 241.70] |
|
| ΔfusH | 8.80 | kJ/mol | 241.65 | NIST |
| ΔfusH | 8.80 | kJ/mol | 241.70 | NIST |
| ΔfusH | 8.80 | kJ/mol | 241.70 | NIST |
| ΔvapH | 51.10 | kJ/mol | 435.50 | NIST |
| ΔfusS | 36.00 | J/mol×K | 241.65 | NIST |
| csound,fluid | [1492.00; 1567.00] | m/s | [303.15; 323.15] |
|
| csound,fluid | 1567.00 | m/s | 303.15 | Thermod... |
| csound,fluid | 1533.00 | m/s | 313.15 | Thermod... |
| csound,fluid | 1492.00 | m/s | 323.15 | Thermod... |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.63] | kPa | [363.13; 504.07] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.43802e+01 | |||
| Coefficient B | -3.58551e+03 | |||
| Coefficient C | -1.08703e+02 | |||
| Temperature range, min. | 363.13 | |||
| Temperature range, max. | 504.07 | |||
| Pvap | 1.33 | kPa | 363.13 | Calculated Property |
| Pvap | 3.02 | kPa | 378.79 | Calculated Property |
| Pvap | 6.25 | kPa | 394.45 | Calculated Property |
| Pvap | 11.99 | kPa | 410.11 | Calculated Property |
| Pvap | 21.58 | kPa | 425.77 | Calculated Property |
| Pvap | 36.75 | kPa | 441.43 | Calculated Property |
| Pvap | 59.65 | kPa | 457.09 | Calculated Property |
| Pvap | 92.87 | kPa | 472.75 | Calculated Property |
| Pvap | 139.41 | kPa | 488.41 | Calculated Property |
| Pvap | 202.63 | kPa | 504.07 | Calculated Property |
| Pvap | [2.20e-04; 4053.78] | kPa | [242.75; 709.15] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 6.48797e+01 | |||
| Coefficient B | -8.59789e+03 | |||
| Coefficient C | -6.91816e+00 | |||
| Coefficient D | 1.91528e-06 | |||
| Temperature range, min. | 242.75 | |||
| Temperature range, max. | 709.15 | |||
| Pvap | 2.20e-04 | kPa | 242.75 | Calculated Property |
| Pvap | 0.03 | kPa | 294.57 | Calculated Property |
| Pvap | 0.85 | kPa | 346.39 | Calculated Property |
| Pvap | 8.79 | kPa | 398.22 | Calculated Property |
| Pvap | 49.28 | kPa | 450.04 | Calculated Property |
| Pvap | 183.23 | kPa | 501.86 | Calculated Property |
| Pvap | 512.41 | kPa | 553.68 | Calculated Property |
| Pvap | 1169.37 | kPa | 605.51 | Calculated Property |
| Pvap | 2300.56 | kPa | 657.33 | Calculated Property |
| Pvap | 4053.78 | kPa | 709.15 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, 3-methyl-.
Mixtures
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Thermodynamic and acoustic properties of binary mixtures of ethers. III. Diisopropyl ether or oxolane with o- or m-toluidines at 303.15, 313.15 and 323.15 K
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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