![2-[1-(4-Cyano-1,2,3,4-tetrahydronaphthyl)]propanenitrile](/cid/89-906-8/2-1-4-Cyano-1-2-3-4-tetrahydronaphthyl-propanenitrile.png "2-[1-(4-Cyano-1,2,3,4-tetrahydronaphthyl)]propanenitrile")
- InChI
- InChI=1S/C14H14N2/c1-10(8-15)12-7-6-11(9-16)13-4-2-3-5-14(12)13/h2-5,10-12H,6-7H2,1H3
- InChI Key
- FDTQTOKRWQJRAC-UHFFFAOYSA-N
- Formula
- C14H14N2
- SMILES
- CC(C#N)C1CCC(C#N)c2ccccc21
- Molecular Weight1
- 210.27
- CAS
- 57964-39-3
- Other Names
-
- 4-(1-Cyanoethyl)-1,2,3,4-tetrahydro-1-naphthalenecarbonitrile
- 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° | 474.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 263.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.26 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 70.04 | kJ/mol | Joback Calculated Property |
| log10WS | -4.07 | Crippen Calculated Property | |
| logPoct/wat | 3.331 | Crippen Calculated Property | |
| McVol | 176.260 | ml/mol | McGowan Calculated Property |
| Pc | 2131.49 | kPa | Joback Calculated Property |
| Inp | [2078.00; 2078.00] |
|
|
| Inp | 2078.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Inp | 2078.00 | NIST | |
| Tboil | 761.44 | K | Joback Calculated Property |
| Tc | 1007.47 | K | Joback Calculated Property |
| Tfus | 411.64 | K | Joback Calculated Property |
| Vc | 0.706 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [496.03; 563.30] | J/mol×K | [761.44; 1007.47] |
|
| Cp,gas | 496.03 | J/mol×K | 761.44 | Joback Calculated Property |
| Cp,gas | 509.67 | J/mol×K | 802.44 | Joback Calculated Property |
| Cp,gas | 522.23 | J/mol×K | 843.45 | Joback Calculated Property |
| Cp,gas | 533.80 | J/mol×K | 884.45 | Joback Calculated Property |
| Cp,gas | 544.45 | J/mol×K | 925.46 | Joback Calculated Property |
| Cp,gas | 554.26 | J/mol×K | 966.46 | Joback Calculated Property |
| Cp,gas | 563.30 | J/mol×K | 1007.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-[1-(4-Cyano-1,2,3,4-tetrahydronaphthyl)]propanenitrile.
Sources
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