- InChI
- InChI=1S/C18H23N/c1-15-9-11-17(12-10-15)18(13-14-19(2)3)16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3
- InChI Key
- CINROOONPHQHPO-UHFFFAOYSA-N
- Formula
- C18H23N
- SMILES
- Cc1ccc(C(CCN(C)C)c2ccccc2)cc1
- Molecular Weight1
- 253.38
- CAS
- 5632-44-0
- Other Names
-
- Benzenepropanamine, N,N,4-trimethyl-«gamma»-phenyl-
- N,N-Dimethyl-3-phenyl-3-p-tolylpropylamine
- N,N-Dimethyl-3-phenyl-3-p-tolylpropamine
- Tolpropamide
- 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° | 424.21 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 108.99 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.53 | kJ/mol | Joback Calculated Property |
| log10WS | -4.26 | Crippen Calculated Property | |
| logPoct/wat | 4.079 | Crippen Calculated Property | |
| McVol | 226.940 | ml/mol | McGowan Calculated Property |
| Pc | 1901.92 | kPa | Joback Calculated Property |
| Inp | 1900.00 | NIST | |
| Tboil | 681.58 | K | Joback Calculated Property |
| Tc | 905.03 | K | Joback Calculated Property |
| Tfus | 375.45 | K | Joback Calculated Property |
| Vc | 0.840 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [617.89; 716.13] | J/mol×K | [681.58; 905.03] | 
|
| Cp,gas | 617.89 | J/mol×K | 681.58 | Joback Calculated Property |
| Cp,gas | 637.41 | J/mol×K | 718.82 | Joback Calculated Property |
| Cp,gas | 655.56 | J/mol×K | 756.06 | Joback Calculated Property |
| Cp,gas | 672.42 | J/mol×K | 793.31 | Joback Calculated Property |
| Cp,gas | 688.09 | J/mol×K | 830.55 | Joback Calculated Property |
| Cp,gas | 702.63 | J/mol×K | 867.79 | Joback Calculated Property |
| Cp,gas | 716.13 | J/mol×K | 905.03 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tolpropamine.
Sources
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