- InChI
- InChI=1S/C7H9N/c1-8-7-5-3-2-4-6-7/h2-6,8H,1H3
- InChI Key
- AFBPFSWMIHJQDM-UHFFFAOYSA-N
- Formula
- C7H9N
- SMILES
- CNc1ccccc1
- Molecular Weight1
- 107.15
- CAS
- 100-61-8
- Other Names
-
- (Methylamino)benzene
- ANILINOMETHANE
- Benzenamine, N-methyl-
- Benzeneamine, N-methyl-
- Methylaniline
- Methylphenylamine
- Monomethylaniline
- N-METHYLBENZENAMINE
- N-Methylaminobenzene
- N-Methylaniline
- N-Methylphenylamine
- N-Monomethylaniline
- N-Phenylmethylamine
- NSC 3502
- UN 2294
- phenylmethylamine
- ω : Acentric Factor.
- 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).
- μ : Dipole Moment (debye).
- 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).
- 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).
- ρl : Liquid Density (kg/m3).
- Inp : Non-polar retention indices.
- I : Polar retention indices.
- 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 |
|---|---|---|---|
| ω | 0.4750 | KDB | |
| PAff | 916.60 | kJ/mol | NIST |
| BasG | 890.10 | kJ/mol | NIST |
| ΔcH°liquid | [-4077.00; -4073.00] | kJ/mol |
|
| ΔcH°liquid | -4073.00 | kJ/mol | NIST |
| ΔcH°liquid | -4077.00 | kJ/mol | NIST |
| μ | 1.70 | debye | KDB |
| ΔfG° | 199.30 | kJ/mol | KDB |
| ΔfH°gas | [83.90; 85.41] | kJ/mol |
|
| ΔfH°gas | 85.41 | kJ/mol | KDB |
| ΔfH°gas | 83.90 ± 6.30 | kJ/mol | NIST |
| ΔfH°gas | 85.40 | kJ/mol | NIST |
| ΔfH°liquid | [32.00; 33.40] | kJ/mol |
|
| ΔfH°liquid | 33.40 ± 7.50 | kJ/mol | NIST |
| ΔfH°liquid | 32.00 | kJ/mol | NIST |
| ΔfusH° | 13.03 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [50.50; 53.40] | kJ/mol |
|
| ΔvapH° | 50.50 ± 4.20 | kJ/mol | NIST |
| ΔvapH° | 50.50 | kJ/mol | NIST |
| ΔvapH° | 53.10 | kJ/mol | NIST |
| ΔvapH° | 53.40 | kJ/mol | NIST |
| IE | [7.30; 7.73] | eV |
|
| IE | 7.32 ± 0.02 | eV | NIST |
| IE | 7.38 ± 0.05 | eV | NIST |
| IE | 7.30 | eV | NIST |
| IE | 7.35 ± 0.02 | eV | NIST |
| IE | 7.32 | eV | NIST |
| IE | 7.30 ± 0.05 | eV | NIST |
| IE | 7.34 ± 0.02 | eV | NIST |
| IE | 7.53 | eV | NIST |
| IE | Outlier 7.73 | eV | NIST |
| log10WS | [-1.28; -1.28] |
|
|
| log10WS | -1.28 | Aq. Sol... | |
| log10WS | -1.28 | Estimat... | |
| logPoct/wat | 1.728 | Crippen Calculated Property | |
| McVol | 95.710 | ml/mol | McGowan Calculated Property |
| Pc | [5197.97; 5200.00] | kPa |
|
| Pc | 5200.00 | kPa | KDB |
| Pc | 5197.97 ± 70.92 | kPa | NIST |
| Inp | [1031.00; 1069.00] |
|
|
| Inp | 1040.40 | NIST | |
| Inp | 1052.20 | NIST | |
| Inp | 1035.00 | NIST | |
| Inp | 1056.00 | NIST | |
| Inp | 1062.00 | NIST | |
| Inp | 1056.00 | NIST | |
| Inp | 1069.00 | NIST | |
| Inp | 1041.00 | NIST | |
| Inp | 1031.00 | NIST | |
| Inp | 1041.00 | NIST | |
| Inp | 1035.00 | NIST | |
| Inp | 1062.00 | NIST | |
| I | [1686.00; 1750.00] |
|
|
| I | 1726.60 | NIST | |
| I | 1747.00 | NIST | |
| I | 1737.00 | NIST | |
| I | 1746.00 | NIST | |
| I | 1750.00 | NIST | |
| I | 1719.80 | NIST | |
| I | 1717.90 | NIST | |
| I | 1746.00 | NIST | |
| I | Outlier 1686.00 | NIST | |
| I | 1711.00 | NIST | |
| I | 1746.00 | NIST | |
| I | 1726.60 | NIST | |
| I | 1719.80 | NIST | |
| Tboil | [464.90; 469.40] | K |
|
| Tboil | 469.40 | K | KDB |
| Tboil | 469.40 | K | NIST |
| Tboil | 467.15 ± 0.40 | K | NIST |
| Tboil | 469.40 ± 0.30 | K | NIST |
| Tboil | 469.40 ± 0.25 | K | NIST |
| Tboil | 469.40 ± 0.30 | K | NIST |
| Tboil | 467.90 ± 0.60 | K | NIST |
| Tboil | 469.25 ± 0.30 | K | NIST |
| Tboil | 467.05 ± 0.50 | K | NIST |
| Tboil | 469.25 ± 0.20 | K | NIST |
| Tboil | Outlier 464.90 ± 1.00 | K | NIST |
| Tboil | 468.90 ± 1.00 | K | NIST |
| Tboil | 468.65 ± 0.50 | K | NIST |
| Tboil | Outlier 465.15 ± 5.00 | K | NIST |
| Tc | 701.00 | K | KDB |
| Tfus | [216.00; 216.00] | K |
|
| Tfus | 216.00 | K | KDB |
| Tfus | 216.00 | K | NIST |
| Vc | 0.354 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [177.91; 239.92] | J/mol×K | [436.41; 651.69] |
|
| Cp,gas | 177.91 | J/mol×K | 436.41 | Joback Calculated Property |
| Cp,gas | 189.97 | J/mol×K | 472.29 | Joback Calculated Property |
| Cp,gas | 201.30 | J/mol×K | 508.17 | Joback Calculated Property |
| Cp,gas | 211.93 | J/mol×K | 544.05 | Joback Calculated Property |
| Cp,gas | 221.89 | J/mol×K | 579.93 | Joback Calculated Property |
| Cp,gas | 231.21 | J/mol×K | 615.81 | Joback Calculated Property |
| Cp,gas | 239.92 | J/mol×K | 651.69 | Joback Calculated Property |
| Cp,liquid | [207.10; 230.10] | J/mol×K | [290.00; 323.15] |
|
| Cp,liquid | 230.10 | J/mol×K | 290.00 | NIST |
| Cp,liquid | 207.10 | J/mol×K | 298.00 | NIST |
| Cp,liquid | 207.12 | J/mol×K | 298.15 | Density... |
| Cp,liquid | 207.12 | J/mol×K | 298.15 | Thermod... |
| Cp,liquid | 210.92 | J/mol×K | 303.15 | Thermod... |
| Cp,liquid | 210.92 | J/mol×K | 303.15 | Density... |
| Cp,liquid | 214.73 | J/mol×K | 308.15 | Density... |
| Cp,liquid | 214.73 | J/mol×K | 308.15 | Thermod... |
| Cp,liquid | 218.53 | J/mol×K | 313.15 | Density... |
| Cp,liquid | 218.53 | J/mol×K | 313.15 | Thermod... |
| Cp,liquid | 222.37 | J/mol×K | 318.15 | Thermod... |
| Cp,liquid | 222.37 | J/mol×K | 318.15 | Density... |
| Cp,liquid | 225.88 | J/mol×K | 323.15 | Thermod... |
| Cp,liquid | 225.88 | J/mol×K | 323.15 | Density... |
| ΔvapH | [45.35; 53.60] | kJ/mol | [389.00; 466.60] |
|
| ΔvapH | 53.60 | kJ/mol | 389.00 | NIST |
| ΔvapH | 45.35 | kJ/mol | 466.60 | NIST |
| Pvap | 0.07 | kPa | 298.15 | Thermod... |
| ρl | [961.13; 989.00] | kg/m3 | [293.00; 323.15] |
|
| ρl | 989.00 | kg/m3 | 293.00 | KDB |
| ρl | 986.44 | kg/m3 | 293.15 | Thermod... |
| ρl | 986.20 | kg/m3 | 293.15 | Excess ... |
| ρl | 982.24 | kg/m3 | 298.15 | Thermod... |
| ρl | 982.40 | kg/m3 | 298.15 | Thermod... |
| ρl | 982.20 | kg/m3 | 298.15 | Excess ... |
| ρl | 982.24 | kg/m3 | 298.15 | Thermod... |
| ρl | 982.49 | kg/m3 | 298.15 | Thermod... |
| ρl | 978.54 | kg/m3 | 303.15 | Thermod... |
| ρl | 978.20 | kg/m3 | 303.15 | Excess ... |
| ρl | 981.72 | kg/m3 | 303.15 | Study o... |
| ρl | 978.20 | kg/m3 | 303.15 | Compara... |
| ρl | 973.53 | kg/m3 | 308.15 | Compara... |
| ρl | 976.04 | kg/m3 | 308.15 | Study o... |
| ρl | 974.20 | kg/m3 | 308.15 | Excess ... |
| ρl | 969.92 | kg/m3 | 313.15 | Compara... |
| ρl | 970.89 | kg/m3 | 313.15 | Study o... |
| ρl | 965.81 | kg/m3 | 318.15 | Study o... |
| ρl | 964.90 | kg/m3 | 318.15 | Compara... |
| ρl | 961.13 | kg/m3 | 323.15 | Study o... |
| csound,fluid | [1477.00; 1582.50] | m/s | [293.15; 323.15] |
|
| csound,fluid | 1582.50 | m/s | 293.15 | Thermod... |
| csound,fluid | 1563.90 | m/s | 298.15 | Thermod... |
| csound,fluid | 1548.00 | m/s | 303.15 | Thermod... |
| csound,fluid | 1546.00 | m/s | 303.15 | Thermod... |
| csound,fluid | 1548.00 | m/s | 303.15 | Thermod... |
| csound,fluid | 1512.00 | m/s | 313.15 | Thermod... |
| csound,fluid | 1512.00 | m/s | 313.15 | Thermod... |
| csound,fluid | 1477.00 | m/s | 323.15 | Thermod... |
| csound,fluid | 1477.00 | m/s | 323.15 | Thermod... |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [349.45; 495.97] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.59126e+01 | |||
| Coefficient B | -4.83070e+03 | |||
| Coefficient C | -4.02870e+01 | |||
| Temperature range, min. | 349.45 | |||
| Temperature range, max. | 495.97 | |||
| Pvap | 1.33 | kPa | 349.45 | Calculated Property |
| Pvap | 2.91 | kPa | 365.73 | Calculated Property |
| Pvap | 5.91 | kPa | 382.01 | Calculated Property |
| Pvap | 11.24 | kPa | 398.29 | Calculated Property |
| Pvap | 20.21 | kPa | 414.57 | Calculated Property |
| Pvap | 34.61 | kPa | 430.85 | Calculated Property |
| Pvap | 56.77 | kPa | 447.13 | Calculated Property |
| Pvap | 89.64 | kPa | 463.41 | Calculated Property |
| Pvap | 136.84 | kPa | 479.69 | Calculated Property |
| Pvap | 202.67 | kPa | 495.97 | Calculated Property |
| Pvap | [9.96e-06; 4869.06] | kPa | [216.15; 701.55] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 7.91078e+01 | |||
| Coefficient B | -9.00734e+03 | |||
| Coefficient C | -9.14371e+00 | |||
| Coefficient D | 4.35509e-06 | |||
| Temperature range, min. | 216.15 | |||
| Temperature range, max. | 701.55 | |||
| Pvap | 9.96e-06 | kPa | 216.15 | Calculated Property |
| Pvap | 5.99e-03 | kPa | 270.08 | Calculated Property |
| Pvap | 0.34 | kPa | 324.02 | Calculated Property |
| Pvap | 5.11 | kPa | 377.95 | Calculated Property |
| Pvap | 35.83 | kPa | 431.88 | Calculated Property |
| Pvap | 153.49 | kPa | 485.82 | Calculated Property |
| Pvap | 475.58 | kPa | 539.75 | Calculated Property |
| Pvap | 1183.16 | kPa | 593.68 | Calculated Property |
| Pvap | 2529.93 | kPa | 647.62 | Calculated Property |
| Pvap | 4869.06 | kPa | 701.55 | Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, N-methyl-.
Mixtures
- Aniline, N-methyl- + Benzyl alcohol
- Aniline, N-methyl- + Tetradecane
- Aniline, N-methyl- + Hexadecane
- Aniline, N-methyl- + Heptane
- Aniline, N-methyl- + Octane
- Aniline, N-methyl- + Decane
- Aniline, N-methyl- + Cyclohexane
- Aniline, N-methyl- + Toluene
- Aniline, N-methyl- + Propanoic acid, 2-hydroxy-, ethyl ester
- Aniline, N-methyl- + Tetrahydrofuran
- 1,3-Dioxolane + Aniline, N-methyl-
- Aniline, N-methyl- + 2-Butanone
- Aniline, N-methyl- + Tetrahydropyran
- Aniline, N-methyl- + Diisopropyl ether
- Aniline, N-methyl- + Acetone
- Aniline, N-methyl- + 2-Pentanone
- Aniline, N-methyl- + 2-Heptanone
- Aniline, N-methyl- + o-Toluidine
- Aniline, N-methyl- + Dimethyl Sulfoxide
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Spectroscopic and ultrasonic studies on the molecular interaction of certain aromatic amines with p-chloranil
- Study on thermo physical properties of binary mixture containing aromatic alcohol with aromatic, substituted aromatic amines at different temperatures interms of FT-IR, 1H NMR spectroscopic and DFT method
- Thermodynamics of mixtures containing amines. XI. Liquid + liquid equilibria and molar excess enthalpies at 298.15 K for N-methylaniline + hydrocarbon systems. Characterization in terms of DISQUAC and ERAS models
- Comparative studies of intermolecular interaction of aromatic amines with ethyl lactate at different temperatures
- Thermodynamic properties and molecular interactions of [Bmim][NTf2]/[Bmim][Pf6] and N-Methylaniline binary systems from T = (298.15 to 323.15) K at 0.1 MPa
- Thermodynamic and acoustic properties of binary mixtures of oxolane with aniline and substituted anilines at 303.15, 313.15 and 323.15 K
- Thermodynamic properties of liquid mixtures containing 1,3-dioxolane and anilines: Excess molar volumes, excess molar enthalpies, excess Gibb's free energy and isentropic compressibilities changes of mixing
- Density, Speed of Sound, and Dynamic Viscosity of 1-Butyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide/1-Butyl-3-methylimidazolium Hexafluorophosphate and N-Methylaniline Binary Systems from T = 298.15 to 323.15 K at 0.1 MPa
- Thermodynamics of Ketone + Amine Mixtures. Part III. Volumetric and Speed of Sound Data at (293.15, 298.15, and 303.15) K for 2-Butanone + Aniline, + N-Methylaniline, or + Pyridine Systems
- Thermodynamic Properties of Binary Mixtures of Tetrahydropyran with Anilines at 308.15 K
- Thermodynamic and Acoustic Properties of Binary Mixtures of Ethers. 2. Diisopropyl Ether with Arylamines at (303.15, 313.15, and 323.15) K and Application of ERAS Model to Aniline Mixtures with Diisopropyl Ether and Oxolane
- Thermodynamics of Ketone + Amine Mixtures. Part VIII. Molar Excess Enthalpies at 298.15 K for n-Alkanone + Aniline or + N-Methylaniline Systems
- Thermodynamics of Mixtures Containing Amines. XII. Volumetric and Speed of Sound Data at (293.15, 298.15, and 303.15) K for N-Methylaniline + Hydrocarbon Systems
- Excess Heat Capacities of Binary and Ternary Mixtures Containing 1-Ethyl-3-methylimidazolium Tetrafluoroborate and Anilines
- Joback Method
- KDB
- Aqueous Solubility Prediction Method
- Estimated Solubility Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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