- InChI
- InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h5,7H,3-4,6,8-9H2,1-2H3
- InChI Key
- YCBSHDKATAPNIA-UHFFFAOYSA-N
- Formula
- C9H18
- SMILES
- CCC=CCCCCC
- Molecular Weight1
- 126.24
- CAS
- 20063-77-8
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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).
- Pvap : Vapor 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 |
|---|---|---|---|
| ω | 0.3585 | Relay (1.0) Calculated Property | |
| ΔfG° | 105.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -142.12 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 44.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.84 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.77 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.533 | Crippen Calculated Property | |
| McVol | 133.370 | ml/mol | McGowan Calculated Property |
| Pc | 2426.65 | kPa | Joback Calculated Property |
| Inp | [896.00; 896.00] |
|
|
| Inp | 896.00 | NIST | |
| Inp | 896.00 | NIST | |
| Tboil | 420.75 ± 0.40 | K | NIST |
| Tc | 591.56 | K | Relay (1.0) Calculated Property |
| Tfus | 171.00 ± 2.00 | K | NIST |
| Vc | 0.518 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [182.40; 453.06] | 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 | -1.94750e+01 | |||
| Coefficient B | 8.78840e-01 | |||
| Coefficient C | -5.49600e-04 | |||
| Coefficient D | 1.43300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 182.40 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 229.00 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 270.40 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 307.08 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 339.47 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 368.03 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 393.22 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 415.48 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 435.28 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 453.06 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0095759; 0.0002052] | Pa×s | [171.00; 406.63] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.12808e+01 | |||
| Coefficient B | 1.13412e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 171.00 | |||
| Temperature range, max. | 406.63 | |||
| η | 0.0095759 | Pa×s | 171.00 | Calculated Property |
| η | 0.0039695 | Pa×s | 197.18 | Calculated Property |
| η | 0.0020227 | Pa×s | 223.36 | Calculated Property |
| η | 0.0011874 | Pa×s | 249.54 | Calculated Property |
| η | 0.0007712 | Pa×s | 275.72 | Calculated Property |
| η | 0.0005398 | Pa×s | 301.91 | Calculated Property |
| η | 0.0004000 | Pa×s | 328.09 | Calculated Property |
| η | 0.0003098 | Pa×s | 354.27 | Calculated Property |
| η | 0.0002486 | Pa×s | 380.45 | Calculated Property |
| η | 0.0002052 | Pa×s | 406.63 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [324.20; 443.18] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.64349e+01 | |||
| Coefficient B | -4.25386e+03 | |||
| Coefficient C | -6.07590e+01 | |||
| Temperature range, min. | 324.20 | |||
| Temperature range, max. | 443.18 | |||
| Pvap | 1.33 | kPa | 324.20 | Calculated Property |
| Pvap | 2.88 | kPa | 337.42 | Calculated Property |
| Pvap | 5.81 | kPa | 350.64 | Calculated Property |
| Pvap | 11.03 | kPa | 363.86 | Calculated Property |
| Pvap | 19.83 | kPa | 377.08 | Calculated Property |
| Pvap | 34.00 | kPa | 390.30 | Calculated Property |
| Pvap | 55.94 | kPa | 403.52 | Calculated Property |
| Pvap | 88.70 | kPa | 416.74 | Calculated Property |
| Pvap | 136.06 | kPa | 429.96 | Calculated Property |
| Pvap | 202.64 | kPa | 443.18 | Calculated Property |
Similar Compounds
Find more compounds similar to 3-Nonene.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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