- InChI
- InChI=1S/C10H16N2/c11-9-7-5-3-1-2-4-6-8-10-12/h1-8H2
- InChI Key
- DFJYZCUIKPGCSG-UHFFFAOYSA-N
- Formula
- C10H16N2
- SMILES
- N#CCCCCCCCCC#N
- Molecular Weight1
- 164.25
- CAS
- 1871-96-1
- Other Names
-
- 1,8-Dicyanooctane
- Octamethylene dicyanide
- Octane-1,8-dicarbonitrile
- Oktamethylendikyanid
- Sebacic acid dinitrile
- sebaconitrile
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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 | 0.6867 | Relay (1.0) Calculated Property | |
| ΔfG° | 299.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 44.18 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.17 | kJ/mol | Fusion and solid-to-solid transitions of a homologous series of alkane-a,w-dinitriles |
| ΔvapH° | 76.56 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.77 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.94 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.154 | Crippen Calculated Property | |
| McVol | 154.520 | ml/mol | McGowan Calculated Property |
| Pc | 2014.51 | kPa | Joback Calculated Property |
| Tboil | 472.70 | K | NIST |
| Tc | 755.56 | K | Relay (1.0) Calculated Property |
| Tfus | 309.80 | K | Relay (1.0) Calculated Property |
| Vc | 0.598 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | 28.20 | kJ/mol | 281.20 | NIST |
| ΔvapH | 83.70 | kJ/mol | 323.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [220.37; 488.20] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | 2.77980e+01 | |||
| Coefficient B | 8.23400e-01 | |||
| Coefficient C | -4.58200e-04 | |||
| Coefficient D | 9.52000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 220.37 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 265.97 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 306.90 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 343.47 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 375.98 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 404.74 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 430.03 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 452.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 471.46 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 488.20 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Decanedinitrile.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Fusion and solid-to-solid transitions of a homologous series of alkane-a,w-dinitriles
- Joback Method
- McGowan Method
- NIST Webbook
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