- InChI
- InChI=1S/C9H16O/c1-3-5-7-9(10)8-6-4-2/h5,7H,3-4,6,8H2,1-2H3/b7-5+
- InChI Key
- FRMKAKWKXLDSSR-FNORWQNLSA-N
- Formula
- C9H16O
- SMILES
- CCC=CC(=O)CCCC
- Molecular Weight1
- 140.22
- CAS
- 82456-34-6
- Other Names
-
- Non-3-en-5-one
- 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).
- 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 |
|---|---|---|---|
| ω | 0.4578 | Relay (... Calculated Property | |
| ΔfG° | -23.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -267.20 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 20.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.64 | kJ/mol | Relay (... Calculated Property |
| IE | 9.21 | eV | Relay (... Calculated Property |
| log10WS | -2.59 | Relay (... Calculated Property | |
| logPoct/wat | 2.712 | Crippen Calculated Property | |
| McVol | 134.940 | ml/mol | McGowan Calculated Property |
| Pc | 2584.59 | kPa | Joback Calculated Property |
| Inp | [1051.00; 1052.00] |
|
|
| Inp | 1051.00 | NIST | |
| Inp | 1051.00 | NIST | |
| Inp | 1052.00 | NIST | |
| Inp | 1051.00 | NIST | |
| I | [1372.00; 1372.00] |
|
|
| I | 1372.00 | NIST | |
| I | 1372.00 | NIST | |
| Tboil | 424.33 | K | Relay (... Calculated Property |
| Tc | 636.40 | K | Relay (... Calculated Property |
| Tfus | 219.55 | K | Relay (... Calculated Property |
| Vc | 0.499 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [281.50; 352.05] | J/mol×K | [463.35; 645.65] |
|
| Cp,gas | 281.50 | J/mol×K | 463.35 | Joback Calculated Property |
| Cp,gas | 294.71 | J/mol×K | 493.73 | Joback Calculated Property |
| Cp,gas | 307.32 | J/mol×K | 524.12 | Joback Calculated Property |
| Cp,gas | 319.33 | J/mol×K | 554.50 | Joback Calculated Property |
| Cp,gas | 330.78 | J/mol×K | 584.89 | Joback Calculated Property |
| Cp,gas | 341.68 | J/mol×K | 615.27 | Joback Calculated Property |
| Cp,gas | 352.05 | J/mol×K | 645.65 | Joback Calculated Property |
| η | [0.0002369; 0.0041736] | Pa×s | [236.04; 463.35] |
|
| η | 0.0041736 | Pa×s | 236.04 | Joback Calculated Property |
| η | 0.0018590 | Pa×s | 273.93 | Joback Calculated Property |
| η | 0.0010078 | Pa×s | 311.81 | Joback Calculated Property |
| η | 0.0006239 | Pa×s | 349.69 | Joback Calculated Property |
| η | 0.0004242 | Pa×s | 387.58 | Joback Calculated Property |
| η | 0.0003089 | Pa×s | 425.47 | Joback Calculated Property |
| η | 0.0002369 | Pa×s | 463.35 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Nonen-5-one.
Sources
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