- InChI
- InChI=1S/C14H13NO/c16-14(11-8-9-11)15-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11H,8-9H2,(H,15,16)
- InChI Key
- POMQVLRIIXEWDN-UHFFFAOYSA-N
- Formula
- C14H13NO
- SMILES
- O=C(Nc1cccc2ccccc12)C1CC1
- Molecular Weight1
- 211.26
- 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° | 297.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 97.53 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 27.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.43 | kJ/mol | Joback Calculated Property |
| log10WS | -3.97 | Crippen Calculated Property | |
| logPoct/wat | 3.188 | Crippen Calculated Property | |
| McVol | 165.590 | ml/mol | McGowan Calculated Property |
| Pc | 3103.64 | kPa | Joback Calculated Property |
| Inp | 2066.00 | NIST | |
| Tboil | 681.14 | K | Joback Calculated Property |
| Tc | 924.21 | K | Joback Calculated Property |
| Tfus | 439.71 | K | Joback Calculated Property |
| Vc | 0.631 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [443.98; 517.13] | J/mol×K | [681.14; 924.21] | 
|
| Cp,gas | 443.98 | J/mol×K | 681.14 | Joback Calculated Property |
| Cp,gas | 458.65 | J/mol×K | 721.65 | Joback Calculated Property |
| Cp,gas | 472.15 | J/mol×K | 762.16 | Joback Calculated Property |
| Cp,gas | 484.62 | J/mol×K | 802.67 | Joback Calculated Property |
| Cp,gas | 496.18 | J/mol×K | 843.18 | Joback Calculated Property |
| Cp,gas | 506.97 | J/mol×K | 883.70 | Joback Calculated Property |
| Cp,gas | 517.13 | J/mol×K | 924.21 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxamide, N-(1-naphthyl)-.
Sources
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