- InChI
- InChI=1S/C11H17N/c1-10(2)8-9-12-11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3
- InChI Key
- HXKYNBCJKDAHOJ-UHFFFAOYSA-N
- Formula
- C11H17N
- SMILES
- CC(C)CCNc1ccccc1
- Molecular Weight1
- 163.26
- CAS
- 2051-84-5
- ω : Acentric Factor.
- 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).
- 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 | 0.4948 | Relay (... Calculated Property | |
| ΔfG° | 241.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -16.62 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 19.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.73 | kJ/mol | Relay (... Calculated Property |
| IE | 7.45 | eV | Relay (... Calculated Property |
| log10WS | -3.29 | Relay (... Calculated Property | |
| logPoct/wat | 3.145 | Crippen Calculated Property | |
| McVol | 152.070 | ml/mol | McGowan Calculated Property |
| Pc | 2707.03 | kPa | Joback Calculated Property |
| Tboil | 529.15 ± 0.50 | K | NIST |
| Tc | 741.92 | K | Relay (... Calculated Property |
| Tfus | 246.01 | K | Relay (... Calculated Property |
| Vc | 0.540 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [350.84; 435.81] | J/mol×K | [527.49; 735.29] | 
|
| Cp,gas | 350.84 | J/mol×K | 527.49 | Joback Calculated Property |
| Cp,gas | 367.24 | J/mol×K | 562.12 | Joback Calculated Property |
| Cp,gas | 382.70 | J/mol×K | 596.76 | Joback Calculated Property |
| Cp,gas | 397.25 | J/mol×K | 631.39 | Joback Calculated Property |
| Cp,gas | 410.92 | J/mol×K | 666.02 | Joback Calculated Property |
| Cp,gas | 423.77 | J/mol×K | 700.66 | Joback Calculated Property |
| Cp,gas | 435.81 | J/mol×K | 735.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Aniline, n-isopentyl-.
Sources
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