- InChI
- InChI=1S/C6H15N/c1-6(2)4-5-7-3/h6-7H,4-5H2,1-3H3
- InChI Key
- QSOCODZVGPDGDA-UHFFFAOYSA-N
- Formula
- C6H15N
- SMILES
- CNCCC(C)C
- Molecular Weight1
- 101.19
- CAS
- 4104-44-3
- Other Names
-
- Butylamine, N,3-dimethyl-
- N-Methylisoamylamine
- N-Methylisopentylamine
- Methyl isopentyl amine
- isoamylmethyl-amine
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 86.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -118.98 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 35.00 | kJ/mol | Joback Calculated Property |
| log10WS | -1.28 | Crippen Calculated Property | |
| logPoct/wat | 1.252 | Crippen Calculated Property | |
| McVol | 105.380 | ml/mol | McGowan Calculated Property |
| Pc | 3181.14 | kPa | Joback Calculated Property |
| Inp | [751.00; 751.00] |
|
|
| Inp | 751.00 | NIST | |
| Inp | 751.00 | NIST | |
| Tboil | [368.15; 382.15] | K |
|
| Tboil | 382.15 ± 3.00 | K | NIST |
| Tboil | 368.15 ± 3.00 | K | NIST |
| Tboil | 381.15 ± 4.00 | K | NIST |
| Tc | 560.25 | K | Joback Calculated Property |
| Tfus | 195.04 | K | Joback Calculated Property |
| Vc | 0.401 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [199.15; 263.15] | J/mol×K | [386.41; 560.25] |
|
| Cp,gas | 199.15 | J/mol×K | 386.41 | Joback Calculated Property |
| Cp,gas | 210.90 | J/mol×K | 415.38 | Joback Calculated Property |
| Cp,gas | 222.20 | J/mol×K | 444.36 | Joback Calculated Property |
| Cp,gas | 233.07 | J/mol×K | 473.33 | Joback Calculated Property |
| Cp,gas | 243.51 | J/mol×K | 502.30 | Joback Calculated Property |
| Cp,gas | 253.53 | J/mol×K | 531.27 | Joback Calculated Property |
| Cp,gas | 263.15 | J/mol×K | 560.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Butanamine, N,3-dimethyl-.
Sources
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