- InChI
- InChI=1S/C14H15N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1,3-4,7-8H,2,5-6,9-10H2
- InChI Key
- ZHOOOLQOWQVYOE-UHFFFAOYSA-N
- Formula
- C14H15N
- SMILES
- N#CC(=C1CCCCC1)c1ccccc1
- Molecular Weight1
- 197.28
- CAS
- 10461-98-0
- Other Names
-
- Cyclohexylidenephenylacetonitrile
- 2-cyclohexyl-2-cyclohexylideneacetonitrile
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -7857.72 | kJ/mol | NIST |
| ΔfG° | 381.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 210.02 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | 204.80 | kJ/mol | NIST |
| ΔfusH° | 17.34 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.12 | kJ/mol | Joback Calculated Property |
| log10WS | -4.57 | Crippen Calculated Property | |
| logPoct/wat | 3.928 | Crippen Calculated Property | |
| McVol | 170.580 | ml/mol | McGowan Calculated Property |
| Pc | 2540.49 | kPa | Joback Calculated Property |
| Tboil | 679.22 | K | Joback Calculated Property |
| Tc | 935.77 | K | Joback Calculated Property |
| Tfus | 346.97 | K | Joback Calculated Property |
| Vc | 0.655 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [446.89; 528.99] | J/mol×K | [679.22; 935.77] | 
|
| Cp,gas | 446.89 | J/mol×K | 679.22 | Joback Calculated Property |
| Cp,gas | 463.70 | J/mol×K | 721.98 | Joback Calculated Property |
| Cp,gas | 479.13 | J/mol×K | 764.74 | Joback Calculated Property |
| Cp,gas | 493.27 | J/mol×K | 807.49 | Joback Calculated Property |
| Cp,gas | 506.23 | J/mol×K | 850.25 | Joback Calculated Property |
| Cp,gas | 518.10 | J/mol×K | 893.01 | Joback Calculated Property |
| Cp,gas | 528.99 | J/mol×K | 935.77 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzeneacetonitrile, «alpha»-cyclohexylidene.
Sources
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