- InChI
- InChI=1S/C11H17N/c12-10-6-2-5-9-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,12H2
- InChI Key
- CGNLNKFBSBFJHY-UHFFFAOYSA-N
- Formula
- C11H17N
- SMILES
- NCCCCCc1ccccc1
- Molecular Weight1
- 163.26
- CAS
- 17734-21-3
- 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 | 0.5708 | Relay (1.0) Calculated Property | |
| ΔfG° | 220.60 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -4.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 23.48 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.55 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.22 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.51 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.358 | Crippen Calculated Property | |
| McVol | 152.070 | ml/mol | McGowan Calculated Property |
| Pc | 2811.36 | kPa | Joback Calculated Property |
| Tboil | 535.54 | K | Relay (1.0) Calculated Property |
| Tc | 742.14 | K | Relay (1.0) Calculated Property |
| Tfus | 285.28 | K | Relay (1.0) Calculated Property |
| Vc | 0.557 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [362.70; 444.02] | J/mol×K | [550.29; 762.50] | 
|
| Cp,gas | 362.70 | J/mol×K | 550.29 | Joback Calculated Property |
| Cp,gas | 378.46 | J/mol×K | 585.66 | Joback Calculated Property |
| Cp,gas | 393.28 | J/mol×K | 621.03 | Joback Calculated Property |
| Cp,gas | 407.21 | J/mol×K | 656.39 | Joback Calculated Property |
| Cp,gas | 420.28 | J/mol×K | 691.76 | Joback Calculated Property |
| Cp,gas | 432.53 | J/mol×K | 727.13 | Joback Calculated Property |
| Cp,gas | 444.02 | J/mol×K | 762.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzenepentanamine.
Sources
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