- InChI
- InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-10(11)12-2/h8-9H,3-7H2,1-2H3/b9-8+
- InChI Key
- ZWNPUELCBZVMDA-CMDGGOBGSA-N
- Formula
- C10H18O2
- SMILES
- CCCCCCC=CC(=O)OC
- Molecular Weight1
- 170.25
- CAS
- 111-79-5
- Other Names
-
- Methyl 2-nonenoate
- Methyl nonylenate
- Neofolione
- methyl non-2-enoate
- 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).
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -120.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -377.31 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.72 | Crippen Calculated Property | |
| logPoct/wat | 2.686 | Crippen Calculated Property | |
| McVol | 154.900 | ml/mol | McGowan Calculated Property |
| Pc | 2311.39 | kPa | Joback Calculated Property |
| Tboil | 508.65 | K | Joback Calculated Property |
| Tc | 688.43 | K | Joback Calculated Property |
| Tfus | 269.54 | K | Joback Calculated Property |
| Vc | 0.600 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [350.74; 425.13] | J/mol×K | [508.65; 688.43] | 
|
| Cp,gas | 350.74 | J/mol×K | 508.65 | Joback Calculated Property |
| Cp,gas | 364.56 | J/mol×K | 538.61 | Joback Calculated Property |
| Cp,gas | 377.79 | J/mol×K | 568.58 | Joback Calculated Property |
| Cp,gas | 390.44 | J/mol×K | 598.54 | Joback Calculated Property |
| Cp,gas | 402.54 | J/mol×K | 628.50 | Joback Calculated Property |
| Cp,gas | 414.10 | J/mol×K | 658.47 | Joback Calculated Property |
| Cp,gas | 425.13 | J/mol×K | 688.43 | Joback Calculated Property |
| η | [0.0001880; 0.0030444] | Pa×s | [269.54; 508.65] |
|
| η | 0.0030444 | Pa×s | 269.54 | Joback Calculated Property |
| η | 0.0014196 | Pa×s | 309.39 | Joback Calculated Property |
| η | 0.0007878 | Pa×s | 349.24 | Joback Calculated Property |
| η | 0.0004933 | Pa×s | 389.10 | Joback Calculated Property |
| η | 0.0003369 | Pa×s | 428.95 | Joback Calculated Property |
| η | 0.0002455 | Pa×s | 468.80 | Joback Calculated Property |
| η | 0.0001880 | Pa×s | 508.65 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [368.99; 510.11] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.57305e+01 | |||
| Coefficient B | -4.51965e+03 | |||
| Coefficient C | -7.63250e+01 | |||
| Temperature range, min. | 368.99 | |||
| Temperature range, max. | 510.11 | |||
| Pvap | 1.33 | kPa | 368.99 | Calculated Property |
| Pvap | 2.92 | kPa | 384.67 | Calculated Property |
| Pvap | 5.94 | kPa | 400.35 | Calculated Property |
| Pvap | 11.31 | kPa | 416.03 | Calculated Property |
| Pvap | 20.35 | kPa | 431.71 | Calculated Property |
| Pvap | 34.82 | kPa | 447.39 | Calculated Property |
| Pvap | 57.06 | kPa | 463.07 | Calculated Property |
| Pvap | 89.97 | kPa | 478.75 | Calculated Property |
| Pvap | 137.09 | kPa | 494.43 | Calculated Property |
| Pvap | 202.64 | kPa | 510.11 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Nonenoic acid, methyl ester.
Sources
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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