- InChI
- InChI=1S/C6H10O2/c1-4-6(7)8-5(2)3/h4-5H,1H2,2-3H3
- InChI Key
- LYBIZMNPXTXVMV-UHFFFAOYSA-N
- Formula
- C6H10O2
- SMILES
- C=CC(=O)OC(C)C
- Molecular Weight1
- 114.14
- CAS
- 689-12-3
- Other Names
-
- 1-methylethyl 2-propenoate
- 2-Propenoic acid, 1-methylethyl ester
- 2-Propenoic acid,isopropyl ester
- Acrylic acid, isopropyl ester
- Isopropyl 2-propenoate
- Isopropyl ester of 2-propenoic acid
- 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.
- 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 | 0.4097 | Relay (1.0) Calculated Property | |
| ΔfG° | -148.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -388.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 9.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.20 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.124 | Crippen Calculated Property | |
| McVol | 98.540 | ml/mol | McGowan Calculated Property |
| Pc | 3468.36 | kPa | Joback Calculated Property |
| Inp | 722.00 | NIST | |
| I | 996.00 | NIST | |
| Tboil | 359.10 | K | Relay (1.0) Calculated Property |
| Tc | 552.50 | K | Relay (1.0) Calculated Property |
| Tfus | 207.00 | K | Relay (1.0) Calculated Property |
| Vc | 0.368 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [184.94; 236.69] | J/mol×K | [409.21; 594.78] | 
|
| Cp,gas | 184.94 | J/mol×K | 409.21 | Joback Calculated Property |
| Cp,gas | 194.42 | J/mol×K | 440.14 | Joback Calculated Property |
| Cp,gas | 203.56 | J/mol×K | 471.07 | Joback Calculated Property |
| Cp,gas | 212.35 | J/mol×K | 502.00 | Joback Calculated Property |
| Cp,gas | 220.81 | J/mol×K | 532.93 | Joback Calculated Property |
| Cp,gas | 228.92 | J/mol×K | 563.86 | Joback Calculated Property |
| Cp,gas | 236.69 | J/mol×K | 594.78 | Joback Calculated Property |
| η | [0.0002586; 0.0040214] | Pa×s | [212.78; 409.21] |
|
| η | 0.0040214 | Pa×s | 212.78 | Joback Calculated Property |
| η | 0.0018765 | Pa×s | 245.52 | Joback Calculated Property |
| η | 0.0010476 | Pa×s | 278.26 | Joback Calculated Property |
| η | 0.0006612 | Pa×s | 311.00 | Joback Calculated Property |
| η | 0.0004556 | Pa×s | 343.73 | Joback Calculated Property |
| η | 0.0003349 | Pa×s | 376.47 | Joback Calculated Property |
| η | 0.0002586 | Pa×s | 409.21 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.64] | kPa | [283.50; 425.89] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.36320e+01 | |||
| Coefficient B | -3.14702e+03 | |||
| Coefficient C | -4.76660e+01 | |||
| Temperature range, min. | 283.50 | |||
| Temperature range, max. | 425.89 | |||
| Pvap | 1.33 | kPa | 283.50 | Calculated Property |
| Pvap | 3.09 | kPa | 299.32 | Calculated Property |
| Pvap | 6.46 | kPa | 315.14 | Calculated Property |
| Pvap | 12.47 | kPa | 330.96 | Calculated Property |
| Pvap | 22.44 | kPa | 346.78 | Calculated Property |
| Pvap | 38.07 | kPa | 362.61 | Calculated Property |
| Pvap | 61.40 | kPa | 378.43 | Calculated Property |
| Pvap | 94.80 | kPa | 394.25 | Calculated Property |
| Pvap | 140.92 | kPa | 410.07 | Calculated Property |
| Pvap | 202.64 | kPa | 425.89 | Calculated Property |
Similar Compounds
Find more compounds similar to Isopropyl acrylate.
Mixtures
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Phase behavior measurement on the binary mixture for isopropyl acrylate and isopropyl methacrylate in supercritical CO2
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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