- InChI
- InChI=1S/C5H13N/c1-3-4-5-6-2/h6H,3-5H2,1-2H3
- InChI Key
- QCOGKXLOEWLIDC-UHFFFAOYSA-N
- Formula
- C5H13N
- SMILES
- CCCCNC
- Molecular Weight1
- 87.16
- CAS
- 110-68-9
- Other Names
-
- Butylamine, N-methyl-
- Butylmethylamine
- Methyl-N-butylamine
- Methylbutylamine
- N-Butyl-N-methylamine
- N-Butylmethylamine
- N-Methyl-n-butylamine
- N-Methylbutanamine
- N-Methylbutylamine
- UN 2945
- N-Methyl-1-butanamine
- ΔcH°liquid : Standard liquid enthalpy of combustion (kJ/mol).
- 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).
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔcH°liquid | -3684.20 ± 3.70 | kJ/mol | NIST |
| ΔfG° | 80.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -108.30 ± 4.30 | kJ/mol | NIST |
| ΔfH°liquid | -141.20 ± 3.80 | kJ/mol | NIST |
| ΔfusH° | 13.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [32.90; 38.10] | kJ/mol |
|
| ΔvapH° | 38.10 | kJ/mol | NIST |
| ΔvapH° | 32.90 ± 2.00 | kJ/mol | NIST |
| ΔvapH° | 32.90 | kJ/mol | NIST |
| log10WS | -1.10 | Crippen Calculated Property | |
| logPoct/wat | 1.006 | Crippen Calculated Property | |
| McVol | 91.290 | ml/mol | McGowan Calculated Property |
| Pc | 3522.09 | kPa | Joback Calculated Property |
| Inp | [601.00; 630.00] |
|
|
| Inp | 630.00 | NIST | |
| Inp | 630.00 | NIST | |
| Inp | 601.00 | NIST | |
| Inp | 630.00 | NIST | |
| Tboil | [363.65; 364.25] | K |
|
| Tboil | 364.20 | K | NIST |
| Tboil | 364.25 | K | NIST |
| Tboil | 364.15 ± 0.60 | K | NIST |
| Tboil | 363.65 ± 3.00 | K | NIST |
| Tc | 534.22 | K | Joback Calculated Property |
| Tfus | [198.15; 198.20] | K |
|
| Tfus | 198.15 | K | NIST |
| Tfus | 198.20 ± 0.60 | K | NIST |
| Tfus | 198.15 ± 0.60 | K | NIST |
| Vc | 0.350 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [162.67; 217.91] | J/mol×K | [363.97; 534.22] |
|
| Cp,gas | 162.67 | J/mol×K | 363.97 | Joback Calculated Property |
| Cp,gas | 172.76 | J/mol×K | 392.35 | Joback Calculated Property |
| Cp,gas | 182.49 | J/mol×K | 420.72 | Joback Calculated Property |
| Cp,gas | 191.86 | J/mol×K | 449.10 | Joback Calculated Property |
| Cp,gas | 200.89 | J/mol×K | 477.47 | Joback Calculated Property |
| Cp,gas | 209.56 | J/mol×K | 505.85 | Joback Calculated Property |
| Cp,gas | 217.91 | J/mol×K | 534.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanamine, N-methyl-.
Sources
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