- InChI
- InChI=1S/C9H17N/c1-2-3-4-5-6-7-8-9-10/h2-8H2,1H3
- InChI Key
- PLZZPPHAMDJOSR-UHFFFAOYSA-N
- Formula
- C9H17N
- SMILES
- CCCCCCCCC#N
- Molecular Weight1
- 139.24
- CAS
- 2243-27-8
- Other Names
-
- 1-cyanooctane
- 1-octyl cyanide
- NSC 5560
- Nonanetrile
- Nonanitrile
- Nonanonitrile
- Nonyl nitrile
- Pelargononitrile
- n-Nonanenitrile
- n-Octylcyanide
- n-nonanonitrile
- n-octanenitrile
- n-octyl cyanide
- octyl cyanide
- pelargonitrile
- PAff : Proton affinity (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).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| PAff | [807.10; 812.00] | kJ/mol |
|
| PAff | 807.10 | kJ/mol | NIST |
| PAff | 812.00 | kJ/mol | NIST |
| ΔfG° | 158.08 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -64.21 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [58.00; 62.00] | kJ/mol |
|
| ΔvapH° | 62.00 ± 0.30 | kJ/mol | NIST |
| ΔvapH° | 58.00 | kJ/mol | NIST |
| log10WS | -3.46 | Crippen Calculated Property | |
| logPoct/wat | 3.261 | Crippen Calculated Property | |
| McVol | 139.050 | ml/mol | McGowan Calculated Property |
| Pc | 2252.53 | kPa | Joback Calculated Property |
| Inp | [199.75; 1185.00] |
|
|
| Inp | 1185.00 | NIST | |
| Inp | 1182.20 | NIST | |
| Inp | 199.75 | NIST | |
| Inp | 1185.00 | NIST | |
| Inp | 1182.20 | NIST | |
| I | [1565.00; 1593.00] |
|
|
| I | 1593.00 | NIST | |
| I | 1593.00 | NIST | |
| I | 1565.00 | NIST | |
| I | 1593.00 | NIST | |
| I | 1565.00 | NIST | |
| Tboil | [488.00; 497.60] | K |
|
| Tboil | 497.60 | K | NIST |
| Tboil | 497.00 ± 1.00 | K | NIST |
| Tboil | 488.00 ± 5.00 | K | NIST |
| Tboil | 488.00 ± 8.00 | K | NIST |
| Tc | 690.60 | K | Joback Calculated Property |
| Tfus | [223.65; 238.95] | K |
|
| Tfus | 223.65 ± 0.50 | K | NIST |
| Tfus | 238.95 ± 1.00 | K | NIST |
| Vc | 0.566 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [314.15; 381.92] | J/mol×K | [507.40; 690.60] |
|
| Cp,gas | 314.15 | J/mol×K | 507.40 | Joback Calculated Property |
| Cp,gas | 326.75 | J/mol×K | 537.93 | Joback Calculated Property |
| Cp,gas | 338.81 | J/mol×K | 568.47 | Joback Calculated Property |
| Cp,gas | 350.34 | J/mol×K | 599.00 | Joback Calculated Property |
| Cp,gas | 361.36 | J/mol×K | 629.53 | Joback Calculated Property |
| Cp,gas | 371.88 | J/mol×K | 660.07 | Joback Calculated Property |
| Cp,gas | 381.92 | J/mol×K | 690.60 | Joback Calculated Property |
| ΔvapH | 56.80 | kJ/mol | 415.50 | NIST |
| Pvap | [1.48e-03; 0.08] | kPa | [273.66; 323.20] |
|
| Pvap | 1.48e-03 | kPa | 273.66 | Extract... |
| Pvap | 2.31e-03 | kPa | 278.15 | Extract... |
| Pvap | 3.70e-03 | kPa | 283.15 | Extract... |
| Pvap | 3.90e-03 | kPa | 285.20 | Vapor P... |
| Pvap | 4.49e-03 | kPa | 286.20 | Vapor P... |
| Pvap | 5.85e-03 | kPa | 288.15 | Extract... |
| Pvap | 5.19e-03 | kPa | 288.20 | Vapor P... |
| Pvap | 6.40e-03 | kPa | 290.20 | Vapor P... |
| Pvap | 7.14e-03 | kPa | 291.70 | Vapor P... |
| Pvap | 9.07e-03 | kPa | 293.15 | Extract... |
| Pvap | 7.97e-03 | kPa | 293.20 | Vapor P... |
| Pvap | 9.92e-03 | kPa | 295.20 | Vapor P... |
| Pvap | 0.01 | kPa | 296.20 | Vapor P... |
| Pvap | 0.01 | kPa | 298.15 | Extract... |
| Pvap | 0.01 | kPa | 298.20 | Vapor P... |
| Pvap | 0.01 | kPa | 299.20 | Vapor P... |
| Pvap | 0.02 | kPa | 301.20 | Vapor P... |
| Pvap | 0.02 | kPa | 302.20 | Vapor P... |
| Pvap | 0.02 | kPa | 303.16 | Extract... |
| Pvap | 0.02 | kPa | 304.20 | Vapor P... |
| Pvap | 0.02 | kPa | 305.20 | Vapor P... |
| Pvap | 0.02 | kPa | 307.20 | Vapor P... |
| Pvap | 0.03 | kPa | 308.18 | Extract... |
| Pvap | 0.03 | kPa | 308.20 | Vapor P... |
| Pvap | 0.03 | kPa | 310.20 | Vapor P... |
| Pvap | 0.04 | kPa | 311.20 | Vapor P... |
| Pvap | 0.04 | kPa | 313.20 | Vapor P... |
| Pvap | 0.05 | kPa | 316.20 | Vapor P... |
| Pvap | 0.05 | kPa | 316.20 | Vapor P... |
| Pvap | 0.06 | kPa | 319.20 | Vapor P... |
| Pvap | 0.07 | kPa | 320.20 | Vapor P... |
| Pvap | 0.08 | kPa | 323.20 | Vapor P... |
Similar Compounds
Find more compounds similar to Nonanenitrile.
Mixtures
Sources
- Crippen Method
- Crippen Method
- Vapor Pressures and Enthalpies of Vaporization of a Series of the Linear Aliphatic Nitriles.
- Extracting Vapor Pressure Data from Gas-Liquid Chromatography Retention Times. Part 2: Analysis of Double Reference Approach
- Excess Enthalpies of {CH3(CH2)nCN, n = 5 to 12} + Methyl Methylthiomethyl Sulfoxide or + Dimethyl Sulfoxide at 298.15 K
- Joback Method
- McGowan Method
- NIST Webbook
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