- InChI
- InChI=1S/C11H15NO/c1-3-12(4-2)11(13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
- InChI Key
- JLNGEXDJAQASHD-UHFFFAOYSA-N
- Formula
- C11H15NO
- SMILES
- CCN(CC)C(=O)c1ccccc1
- Molecular Weight1
- 177.24
- CAS
- 1696-17-9
- Other Names
-
- Benzamide, N,N-diethyl-
- Benzoic acid diethylamide
- Benzoic acid N,N-diethylamide
- Benzoyldiethylamine
- N,N-Diethylbenzamide
- R 2
- Rebemid
- R 2 (insect repellant)
- REP
- NSC 16060
- 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).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | 136.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -78.89 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.91 | kJ/mol | Joback Calculated Property |
| ΔsubH° | 91.40 ± 3.20 | kJ/mol | NIST |
| ΔvapH° | 51.14 | kJ/mol | Joback Calculated Property |
| log10WS | -2.45 | Crippen Calculated Property | |
| logPoct/wat | 2.169 | Crippen Calculated Property | |
| McVol | 153.640 | ml/mol | McGowan Calculated Property |
| Pc | 2823.32 | kPa | Joback Calculated Property |
| Inp | [1456.00; 1456.00] |
|
|
| Inp | 1456.00 | NIST | |
| Inp | 1456.00 | NIST | |
| Tboil | 544.07 | K | Joback Calculated Property |
| Tc | 752.53 | K | Joback Calculated Property |
| Tfus | 322.55 | K | Joback Calculated Property |
| Vc | 0.568 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [356.38; 435.45] | J/mol×K | [544.07; 752.53] |
|
| Cp,gas | 356.38 | J/mol×K | 544.07 | Joback Calculated Property |
| Cp,gas | 371.81 | J/mol×K | 578.81 | Joback Calculated Property |
| Cp,gas | 386.29 | J/mol×K | 613.56 | Joback Calculated Property |
| Cp,gas | 399.85 | J/mol×K | 648.30 | Joback Calculated Property |
| Cp,gas | 412.53 | J/mol×K | 683.04 | Joback Calculated Property |
| Cp,gas | 424.39 | J/mol×K | 717.79 | Joback Calculated Property |
| Cp,gas | 435.45 | J/mol×K | 752.53 | Joback Calculated Property |
| ΔvapH | [53.20; 56.50] | kJ/mol | [388.00; 389.50] |
|
| ΔvapH | 56.50 | kJ/mol | 388.00 | NIST |
| ΔvapH | 53.20 | kJ/mol | 389.50 | NIST |
Similar Compounds
Find more compounds similar to Rebemide.
Sources
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