- InChI
- InChI=1S/C6H15N/c1-3-5-6-7-4-2/h7H,3-6H2,1-2H3
- InChI Key
- QHCCDDQKNUYGNC-UHFFFAOYSA-N
- Formula
- C6H15N
- SMILES
- CCCCNCC
- Molecular Weight1
- 101.19
- CAS
- 13360-63-9
- Other Names
-
- Butylamine, N-ethyl-
- Butylethylamine
- Ethyl-n-butylamine
- Ethylbutylamine
- N-Butyl-N-ethylamine
- N-Butylethylamine
- N-Ethyl-n-butylamine
- N-Ethyl-normal-butylamine
- N-Ethylbutanamine
- N-Ethylbutylamine
- N-n-Butylethylamine
- 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).
- 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.
- 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 | 0.4009 | Relay (1.0) Calculated Property | |
| ΔfG° | 89.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -111.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [40.19; 41.40] | kJ/mol |
|
| ΔvapH° | 40.19 | kJ/mol | NIST |
| ΔvapH° | 41.40 | kJ/mol | NIST |
| ΔvapH° | 40.20 ± 0.10 | kJ/mol | NIST |
| IE | 8.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.40 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.396 | Crippen Calculated Property | |
| McVol | 105.380 | ml/mol | McGowan Calculated Property |
| Pc | 3152.62 | kPa | Joback Calculated Property |
| Inp | [744.00; 753.00] |
|
|
| Inp | 753.00 | NIST | |
| Inp | 744.00 | NIST | |
| Inp | 753.00 | NIST | |
| Tboil | [380.60; 384.25] | K |
|
| Tboil | 381.70 | K | NIST |
| Tboil | 383.00 | K | NIST |
| Tboil | 380.60 | K | NIST |
| Tboil | 384.25 ± 0.30 | K | NIST |
| Tboil | 381.15 | K | NIST |
| Tboil | 381.65 ± 2.00 | K | NIST |
| Tc | 547.10 | K | NIST |
| Tfus | 194.95 | K | NIST |
| Vc | 0.399 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [199.23; 261.47] | J/mol×K | [386.85; 556.73] |
|
| Cp,gas | 199.23 | J/mol×K | 386.85 | Joback Calculated Property |
| Cp,gas | 210.62 | J/mol×K | 415.16 | Joback Calculated Property |
| Cp,gas | 221.60 | J/mol×K | 443.48 | Joback Calculated Property |
| Cp,gas | 232.16 | J/mol×K | 471.79 | Joback Calculated Property |
| Cp,gas | 242.32 | J/mol×K | 500.10 | Joback Calculated Property |
| Cp,gas | 252.08 | J/mol×K | 528.41 | Joback Calculated Property |
| Cp,gas | 261.47 | J/mol×K | 556.73 | Joback Calculated Property |
| ΔvapH | [33.97; 39.90] | kJ/mol | [313.00; 380.60] |
|
| ΔvapH | 39.10 ± 0.10 | kJ/mol | 313.00 | NIST |
| ΔvapH | 38.00 ± 0.10 | kJ/mol | 328.00 | NIST |
| ΔvapH | 36.90 ± 0.10 | kJ/mol | 343.00 | NIST |
| ΔvapH | 39.90 | kJ/mol | 344.00 | NIST |
| ΔvapH | 35.80 ± 0.10 | kJ/mol | 358.00 | NIST |
| ΔvapH | 33.97 | kJ/mol | 380.60 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [288.81; 405.52] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.40218e+01 | |||
| Coefficient B | -2.77900e+03 | |||
| Coefficient C | -8.64710e+01 | |||
| Temperature range, min. | 288.81 | |||
| Temperature range, max. | 405.52 | |||
| Pvap | 1.33 | kPa | 288.81 | Calculated Property |
| Pvap | 3.05 | kPa | 301.78 | Calculated Property |
| Pvap | 6.35 | kPa | 314.75 | Calculated Property |
| Pvap | 12.21 | kPa | 327.71 | Calculated Property |
| Pvap | 21.97 | kPa | 340.68 | Calculated Property |
| Pvap | 37.36 | kPa | 353.65 | Calculated Property |
| Pvap | 60.46 | kPa | 366.62 | Calculated Property |
| Pvap | 93.77 | kPa | 379.58 | Calculated Property |
| Pvap | 140.12 | kPa | 392.55 | Calculated Property |
| Pvap | 202.66 | kPa | 405.52 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanamine, N-ethyl-.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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