- InChI
- InChI=1S/C9H13N/c1-8(2)10-9-6-4-3-5-7-9/h3-8,10H,1-2H3
- InChI Key
- FRCFWPVMFJMNDP-UHFFFAOYSA-N
- Formula
- C9H13N
- SMILES
- CC(C)Nc1ccccc1
- Molecular Weight1
- 135.21
- CAS
- 768-52-5
- Other Names
-
- Aniline, N-isopropyl-
- Isopropylaniline
- N-(1-Methylethyl)benzenamine
- N-(1-Methylethyl)phenylamine
- N-Isopropyl-N-phenylamine
- N-Isopropylaniline
- N-Isopropylbenzenamine
- N-Phenylisopropylamine
- Phenylisopropylamine
- 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° | 224.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 55.63 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.95 | kJ/mol | Joback Calculated Property |
| IE | 7.50 | eV | NIST |
| log10WS | -2.43 | Crippen Calculated Property | |
| logPoct/wat | 2.507 | Crippen Calculated Property | |
| McVol | 123.890 | ml/mol | McGowan Calculated Property |
| Pc | 3341.24 | kPa | Joback Calculated Property |
| Inp | 1127.20 | NIST | |
| Tboil | 481.73 | K | Joback Calculated Property |
| Tc | 696.01 | K | Joback Calculated Property |
| Tfus | 255.27 | K | Joback Calculated Property |
| Vc | 0.461 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [260.51; 336.35] | J/mol×K | [481.73; 696.01] | 
|
| Cp,gas | 260.51 | J/mol×K | 481.73 | Joback Calculated Property |
| Cp,gas | 275.23 | J/mol×K | 517.44 | Joback Calculated Property |
| Cp,gas | 289.07 | J/mol×K | 553.16 | Joback Calculated Property |
| Cp,gas | 302.07 | J/mol×K | 588.87 | Joback Calculated Property |
| Cp,gas | 314.25 | J/mol×K | 624.59 | Joback Calculated Property |
| Cp,gas | 325.67 | J/mol×K | 660.30 | Joback Calculated Property |
| Cp,gas | 336.35 | J/mol×K | 696.01 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 368.50 ± 0.50 | K | 2.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [355.92; 539.04] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.30590e+01 | |||
| Coefficient B | -3.60663e+03 | |||
| Coefficient C | -7.35200e+01 | |||
| Temperature range, min. | 355.92 | |||
| Temperature range, max. | 539.04 | |||
| Pvap | 1.33 | kPa | 355.92 | Calculated Property |
| Pvap | 3.15 | kPa | 376.27 | Calculated Property |
| Pvap | 6.66 | kPa | 396.61 | Calculated Property |
| Pvap | 12.90 | kPa | 416.96 | Calculated Property |
| Pvap | 23.22 | kPa | 437.31 | Calculated Property |
| Pvap | 39.25 | kPa | 457.65 | Calculated Property |
| Pvap | 62.94 | kPa | 478.00 | Calculated Property |
| Pvap | 96.48 | kPa | 498.35 | Calculated Property |
| Pvap | 142.21 | kPa | 518.69 | Calculated Property |
| Pvap | 202.64 | kPa | 539.04 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzenamine, N-(1-methylethyl)-.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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