- InChI
- InChI=1S/C9H9N/c1-4-7-10(8-5-2)9-6-3/h1-3H,7-9H2
- InChI Key
- ZHOBJWVNWMQMLF-UHFFFAOYSA-N
- Formula
- C9H9N
- SMILES
- C#CCN(CC#C)CC#C
- Molecular Weight1
- 131.17
- CAS
- 6921-29-5
- Other Names
-
- Tripropargylamine
- Tri-2-propynylamine
- (HC«equiv»CCH2)3N
- Tris(2-propynyl)amine
- tris(propyn-2-yl)amine
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 |
|---|---|---|---|
| PAff | 925.20 | kJ/mol | NIST |
| BasG | 894.40 | kJ/mol | NIST |
| ΔcH°liquid | -5642.12 ± 0.42 | kJ/mol | NIST |
| ΔfG° | 804.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 714.14 | kJ/mol | Joback Calculated Property |
| ΔfH°liquid | [671.10; 814.20] | kJ/mol |
|
| ΔfH°liquid | 671.10 ± 5.90 | kJ/mol | NIST |
| ΔfH°liquid | 814.20 ± 0.40 | kJ/mol | NIST |
| ΔfusH° | 31.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.25 | kJ/mol | Joback Calculated Property |
| log10WS | -1.54 | Crippen Calculated Property | |
| logPoct/wat | 0.188 | Crippen Calculated Property | |
| McVol | 121.850 | ml/mol | McGowan Calculated Property |
| Pc | 3718.02 | kPa | Joback Calculated Property |
| Tboil | 388.12 | K | Joback Calculated Property |
| Tc | 587.22 | K | Joback Calculated Property |
| Tfus | 364.57 | K | Joback Calculated Property |
| Vc | 0.444 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [223.15; 279.92] | J/mol×K | [388.12; 587.22] |
|
| Cp,gas | 223.15 | J/mol×K | 388.12 | Joback Calculated Property |
| Cp,gas | 234.28 | J/mol×K | 421.30 | Joback Calculated Property |
| Cp,gas | 244.69 | J/mol×K | 454.49 | Joback Calculated Property |
| Cp,gas | 254.42 | J/mol×K | 487.67 | Joback Calculated Property |
| Cp,gas | 263.50 | J/mol×K | 520.86 | Joback Calculated Property |
| Cp,gas | 271.99 | J/mol×K | 554.04 | Joback Calculated Property |
| Cp,gas | 279.92 | J/mol×K | 587.22 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 355.20 | K | 1.50 | NIST |
Similar Compounds
Find more compounds similar to 2-Propyn-1-amine, N,N-di-2-propynyl-.
Sources
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