- InChI
- InChI=1S/C9H16O/c1-3-5-6-7-8-9(10)4-2/h4H,2-3,5-8H2,1H3
- InChI Key
- HILCQVNWWOARMT-UHFFFAOYSA-N
- Formula
- C9H16O
- SMILES
- C=CC(=O)CCCCCC
- Molecular Weight1
- 140.22
- Other Names
-
- non-1-en-3-one
- 1-nonene-3-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.
- Ip : 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 | 0.5127 | Relay (1.0) Calculated Property | |
| ΔfG° | -16.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -246.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.40 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.56 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.712 | Crippen Calculated Property | |
| McVol | 134.940 | ml/mol | McGowan Calculated Property |
| Pc | 2558.51 | kPa | Joback Calculated Property |
| Inp | [1052.00; 1080.00] |
|
|
| Inp | 1076.00 | NIST | |
| Inp | 1078.00 | NIST | |
| Inp | 1076.00 | NIST | |
| Inp | 1052.00 | NIST | |
| Inp | 1052.00 | NIST | |
| Inp | 1059.00 | NIST | |
| Inp | 1077.00 | NIST | |
| Inp | 1080.00 | NIST | |
| Ip | [1395.00; 1433.00] |
|
|
| Ip | 1396.00 | NIST | |
| Ip | 1432.00 | NIST | |
| Ip | 1424.00 | NIST | |
| Ip | 1424.00 | NIST | |
| Ip | 1418.00 | NIST | |
| Ip | 1430.00 | NIST | |
| Ip | 1433.00 | NIST | |
| Ip | 1398.00 | NIST | |
| Ip | 1427.00 | NIST | |
| Ip | 1428.00 | NIST | |
| Ip | 1430.00 | NIST | |
| Ip | 1422.00 | NIST | |
| Ip | 1410.00 | NIST | |
| Ip | 1405.00 | NIST | |
| Ip | 1405.00 | NIST | |
| Ip | 1400.00 | NIST | |
| Ip | 1395.00 | NIST | |
| Ip | 1395.00 | NIST | |
| Ip | 1418.00 | NIST | |
| Ip | 1428.00 | NIST | |
| Ip | 1405.00 | NIST | |
| Ip | 1396.00 | NIST | |
| Ip | 1400.00 | NIST | |
| Tboil | 430.11 | K | Relay (1.0) Calculated Property |
| Tc | 651.01 | K | Relay (1.0) Calculated Property |
| Tfus | 235.01 | K | Relay (1.0) Calculated Property |
| Vc | 0.510 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [187.52; 444.16] | 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 | -9.25000e-01 | |||
| Coefficient B | 8.10820e-01 | |||
| Coefficient C | -4.70000e-04 | |||
| Coefficient D | 1.04260e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 187.52 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 231.72 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 271.22 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 306.37 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 337.49 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 364.90 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 388.95 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 409.95 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 428.24 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 444.15 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0040460; 0.0003079] | Pa×s | [239.36; 443.62] |
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 | -1.11037e+01 | |||
| Coefficient B | 1.33891e+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. | 239.36 | |||
| Temperature range, max. | 443.62 | |||
| η | 0.0040460 | Pa×s | 239.36 | Calculated Property |
| η | 0.0024925 | Pa×s | 262.06 | Calculated Property |
| η | 0.0016587 | Pa×s | 284.75 | Calculated Property |
| η | 0.0011723 | Pa×s | 307.45 | Calculated Property |
| η | 0.0008690 | Pa×s | 330.14 | Calculated Property |
| η | 0.0006695 | Pa×s | 352.84 | Calculated Property |
| η | 0.0005323 | Pa×s | 375.53 | Calculated Property |
| η | 0.0004344 | Pa×s | 398.23 | Calculated Property |
| η | 0.0003624 | Pa×s | 420.92 | Calculated Property |
| η | 0.0003079 | Pa×s | 443.62 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-nonen-3-one.
Sources
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