- InChI
- InChI=1S/C10H9N/c11-8-10(6-7-10)9-4-2-1-3-5-9/h1-5H,6-7H2
- InChI Key
- ZHFURHRJUWYDKG-UHFFFAOYSA-N
- Formula
- C10H9N
- SMILES
- N#CC1(c2ccccc2)CC1
- Molecular Weight1
- 143.19
- CAS
- 935-44-4
- Other Names
-
- Cyclopropanecarbonitrile, 1-phenyl-
- 1-Phenyl-cyclopropanecarbonitrile
- 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).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | 334.17 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 239.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.37 | kJ/mol | Joback Calculated Property |
| log10WS | -2.55 | Crippen Calculated Property | |
| logPoct/wat | 2.242 | Crippen Calculated Property | |
| McVol | 118.520 | ml/mol | McGowan Calculated Property |
| Pc | 3472.45 | kPa | Joback Calculated Property |
| Tboil | 563.94 | K | Joback Calculated Property |
| Tc | 815.04 | K | Joback Calculated Property |
| Tfus | 335.71 | K | Joback Calculated Property |
| Vc | 0.469 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [272.11; 335.59] | J/mol×K | [563.94; 815.04] | 
|
| Cp,gas | 272.11 | J/mol×K | 563.94 | Joback Calculated Property |
| Cp,gas | 284.73 | J/mol×K | 605.79 | Joback Calculated Property |
| Cp,gas | 296.22 | J/mol×K | 647.64 | Joback Calculated Property |
| Cp,gas | 306.83 | J/mol×K | 689.49 | Joback Calculated Property |
| Cp,gas | 316.77 | J/mol×K | 731.34 | Joback Calculated Property |
| Cp,gas | 326.28 | J/mol×K | 773.19 | Joback Calculated Property |
| Cp,gas | 335.59 | J/mol×K | 815.04 | Joback Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 408.20 | K | 4.00 | NIST |
Similar Compounds
Find more compounds similar to 1-Phenyl-1-cyclopropanecarbonitrile.
Sources
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