- InChI
- InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)
- InChI Key
- REQCZEXYDRLIBE-UHFFFAOYSA-N
- Formula
- C13H21N3O
- SMILES
- CCN(CC)CCNC(=O)c1ccc(N)cc1
- Molecular Weight1
- 235.33
- CAS
- 51-06-9
- Other Names
-
- Benzamide, 4-amino-N-[2-(diethylamino)ethyl]-
- Benzamide, p-amino-N-[2-(diethylamino)ethyl]-
- p-Amino-N-(2-diethylaminoethyl)benzamide
- p-Aminobenzoic diethylaminoethylamide
- Novocainamid
- Novocainamide
- Novocaine amide
- Novocamid
- Procaine amide
- Procamide
- Biocoryl
- Procapan (free base)
- Pronestyl
- 2-Diethylaminoethylamid kyseliny p-aminobenzoove
- 4-Amino-N-(diethylaminoethyl)benzamide
- NSC 27461
- 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° | 299.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -44.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.34 | kJ/mol | Joback Calculated Property |
| log10WS | -2.11 | Crippen Calculated Property | |
| logPoct/wat | 1.340 | Crippen Calculated Property | |
| McVol | 201.780 | ml/mol | McGowan Calculated Property |
| Pc | 2453.17 | kPa | Joback Calculated Property |
| Inp | [2193.00; 2250.00] |
|
|
| Inp | 2193.00 | NIST | |
| Inp | 2193.00 | NIST | |
| Inp | 2250.00 | NIST | |
| Inp | 2245.00 | NIST | |
| Inp | 2240.00 | NIST | |
| Inp | 2248.00 | NIST | |
| Inp | 2193.00 | NIST | |
| Inp | 2245.00 | NIST | |
| Tboil | 717.51 | K | Joback Calculated Property |
| Tc | 927.86 | K | Joback Calculated Property |
| Tfus | 493.53 | K | Joback Calculated Property |
| Vc | 0.744 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [573.45; 648.98] | J/mol×K | [717.51; 927.86] |
|
| Cp,gas | 573.45 | J/mol×K | 717.51 | Joback Calculated Property |
| Cp,gas | 588.30 | J/mol×K | 752.57 | Joback Calculated Property |
| Cp,gas | 602.18 | J/mol×K | 787.63 | Joback Calculated Property |
| Cp,gas | 615.14 | J/mol×K | 822.69 | Joback Calculated Property |
| Cp,gas | 627.23 | J/mol×K | 857.75 | Joback Calculated Property |
| Cp,gas | 638.49 | J/mol×K | 892.80 | Joback Calculated Property |
| Cp,gas | 648.98 | J/mol×K | 927.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Procainamide.
Sources
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