- InChI
- InChI=1S/C9H11NO/c1-8(10-7-11)9-5-3-2-4-6-9/h2-8H,1H3,(H,10,11)
- InChI Key
- CDHCCWRMWKZBGE-UHFFFAOYSA-N
- Formula
- C9H11NO
- SMILES
- CC(NC=O)c1ccccc1
- Molecular Weight1
- 149.19
- CAS
- 6948-01-2
- Other Names
-
- Formamide, N-(1-phenylethyl)-
- N-Phenylethylformamide
- N-(1-phenylethyl)formamide
- 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).
- 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 | 0.4324 | Relay (1.0) Calculated Property | |
| ΔfG° | 124.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -108.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.28 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.99 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.63 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.494 | Crippen Calculated Property | |
| McVol | 125.460 | ml/mol | McGowan Calculated Property |
| Pc | 3646.53 | kPa | Joback Calculated Property |
| Tboil | 525.31 | K | Relay (1.0) Calculated Property |
| Tc | 757.59 | K | Relay (1.0) Calculated Property |
| Tfus | 296.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.440 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [279.87; 346.18] | J/mol×K | [530.39; 748.75] | 
|
| Cp,gas | 279.87 | J/mol×K | 530.39 | Joback Calculated Property |
| Cp,gas | 292.93 | J/mol×K | 566.78 | Joback Calculated Property |
| Cp,gas | 305.14 | J/mol×K | 603.18 | Joback Calculated Property |
| Cp,gas | 316.53 | J/mol×K | 639.57 | Joback Calculated Property |
| Cp,gas | 327.14 | J/mol×K | 675.96 | Joback Calculated Property |
| Cp,gas | 337.01 | J/mol×K | 712.36 | Joback Calculated Property |
| Cp,gas | 346.18 | J/mol×K | 748.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-(«alpha»-Methylbenzyl)-formamide.
Sources
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