- InChI
- InChI=1S/C11H21N/c1-4-7-10-12(9-6-3)11-8-5-2/h3H,4-5,7-11H2,1-2H3
- InChI Key
- XTEBRELWTGWYDE-UHFFFAOYSA-N
- Formula
- C11H21N
- SMILES
- C#CCN(CCCC)CCCC
- Molecular Weight1
- 167.29
- CAS
- 6336-58-9
- 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 | 0.4465 | Relay (1.0) Calculated Property | |
| ΔfG° | 375.59 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 78.31 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 30.24 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.522 | Crippen Calculated Property | |
| McVol | 167.230 | ml/mol | McGowan Calculated Property |
| Pc | 2208.29 | kPa | Joback Calculated Property |
| Tboil | 470.51 | K | Relay (1.0) Calculated Property |
| Tc | 629.66 | K | Relay (1.0) Calculated Property |
| Tfus | 210.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.592 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [361.18; 445.97] | J/mol×K | [453.64; 624.36] | 
|
| Cp,gas | 361.18 | J/mol×K | 453.64 | Joback Calculated Property |
| Cp,gas | 376.97 | J/mol×K | 482.09 | Joback Calculated Property |
| Cp,gas | 392.07 | J/mol×K | 510.55 | Joback Calculated Property |
| Cp,gas | 406.49 | J/mol×K | 539.00 | Joback Calculated Property |
| Cp,gas | 420.26 | J/mol×K | 567.45 | Joback Calculated Property |
| Cp,gas | 433.42 | J/mol×K | 595.91 | Joback Calculated Property |
| Cp,gas | 445.97 | J/mol×K | 624.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Dibutylamino-1-propyne.
Sources
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