- InChI
- InChI=1S/C13H19NO/c1-4-5-10-14(3)13(15)12-9-7-6-8-11(12)2/h6-9H,4-5,10H2,1-3H3
- InChI Key
- SBEPAEVAHVICAQ-UHFFFAOYSA-N
- Formula
- C13H19NO
- SMILES
- CCCCN(C)C(=O)c1ccccc1C
- Molecular Weight1
- 205.30
- 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).
- 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 |
|---|---|---|---|
| ω | 0.6044 | Relay (1.0) Calculated Property | |
| ΔfG° | 143.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -187.25 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 27.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.91 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.47 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.89 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.867 | Crippen Calculated Property | |
| McVol | 181.820 | ml/mol | McGowan Calculated Property |
| Pc | 2291.52 | kPa | Joback Calculated Property |
| Inp | [1962.00; 1962.00] |
|
|
| Inp | 1962.00 | NIST | |
| Inp | 1962.00 | NIST | |
| Tboil | 571.28 | K | Relay (1.0) Calculated Property |
| Tc | 770.36 | K | Relay (1.0) Calculated Property |
| Tfus | 284.61 | K | Relay (1.0) Calculated Property |
| Vc | 0.672 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [453.71; 538.29] | J/mol×K | [594.81; 797.96] |
|
| Cp,gas | 453.71 | J/mol×K | 594.81 | Joback Calculated Property |
| Cp,gas | 470.05 | J/mol×K | 628.67 | Joback Calculated Property |
| Cp,gas | 485.45 | J/mol×K | 662.53 | Joback Calculated Property |
| Cp,gas | 499.93 | J/mol×K | 696.39 | Joback Calculated Property |
| Cp,gas | 513.54 | J/mol×K | 730.25 | Joback Calculated Property |
| Cp,gas | 526.31 | J/mol×K | 764.10 | Joback Calculated Property |
| Cp,gas | 538.29 | J/mol×K | 797.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzamide, 2-methyl-N-butyl-N-methyl-.
Sources
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