- InChI
- InChI=1S/C8H19N/c1-4-5-6-7-8(2)9-3/h8-9H,4-7H2,1-3H3
- InChI Key
- BGWFQRDYRSCOCO-UHFFFAOYSA-N
- Formula
- C8H19N
- SMILES
- CCCCCC(C)NC
- Molecular Weight1
- 129.24
- CAS
- 540-43-2
- Other Names
-
- Hexylamine, N,1-dimethyl-
- Neosupranol
- Oenethyl
- Pacamine
- 2-Heptanamine, N-methyl-
- 2-Heptylmethylamine
- 2-Methylaminoheptane
- Methyl(2-heptyl)amine
- NSC 27122
- Methylaminoheptane
- 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).
- Inp : Non-polar retention indices.
- I : 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 | 0.4348 | Relay (1.0) Calculated Property | |
| ΔfG° | 103.43 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -155.76 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 18.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.67 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.06 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.34 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.175 | Crippen Calculated Property | |
| McVol | 133.560 | ml/mol | McGowan Calculated Property |
| Pc | 2589.85 | kPa | Joback Calculated Property |
| Inp | [982.00; 992.00] |
|
|
| Inp | 990.00 | NIST | |
| Inp | 982.00 | NIST | |
| Inp | 991.00 | NIST | |
| Inp | 992.00 | NIST | |
| I | [1126.00; 1147.00] |
|
|
| I | 1130.00 | NIST | |
| I | 1126.00 | NIST | |
| I | 1127.00 | NIST | |
| I | Outlier 1147.00 | NIST | |
| I | 1130.00 | NIST | |
| I | 1126.00 | NIST | |
| Tboil | 426.96 | K | Relay (1.0) Calculated Property |
| Tc | 598.89 | K | Relay (1.0) Calculated Property |
| Tfus | 237.70 | K | Relay (1.0) Calculated Property |
| Vc | 0.497 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [279.40; 355.50] | J/mol×K | [432.17; 604.23] |
|
| Cp,gas | 279.40 | J/mol×K | 432.17 | Joback Calculated Property |
| Cp,gas | 293.41 | J/mol×K | 460.85 | Joback Calculated Property |
| Cp,gas | 306.87 | J/mol×K | 489.52 | Joback Calculated Property |
| Cp,gas | 319.80 | J/mol×K | 518.20 | Joback Calculated Property |
| Cp,gas | 332.20 | J/mol×K | 546.88 | Joback Calculated Property |
| Cp,gas | 344.10 | J/mol×K | 575.56 | Joback Calculated Property |
| Cp,gas | 355.50 | J/mol×K | 604.23 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,1-Dimethylhexylamine.
Sources
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Outlier This icon means
that the value is more than 2 standard deviations away from the
property mean.