- InChI
- InChI=1S/C10H20O2/c1-7-12-8(11)10(5,6)9(2,3)4/h7H2,1-6H3
- InChI Key
- ISDTWPKODWTCFS-UHFFFAOYSA-N
- Formula
- C10H20O2
- SMILES
- CCOC(=O)C(C)(C)C(C)(C)C
- Molecular Weight1
- 172.27
- 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.
- 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 | 0.4130 | Relay (1.0) Calculated Property | |
| ΔfG° | -271.37 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -582.53 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.08 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.39 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.68 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.622 | Crippen Calculated Property | |
| McVol | 159.200 | ml/mol | McGowan Calculated Property |
| Pc | 2193.84 | kPa | Joback Calculated Property |
| Inp | [987.00; 987.00] |
|
|
| Inp | 987.00 | NIST | |
| Inp | 987.00 | NIST | |
| Tboil | 437.73 | K | Relay (1.0) Calculated Property |
| Tc | 646.41 | K | Relay (1.0) Calculated Property |
| Tfus | 304.81 | K | Relay (1.0) Calculated Property |
| Vc | 0.566 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [366.98; 454.68] | J/mol×K | [480.16; 670.61] |
|
| Cp,gas | 366.98 | J/mol×K | 480.16 | Joback Calculated Property |
| Cp,gas | 383.84 | J/mol×K | 511.90 | Joback Calculated Property |
| Cp,gas | 399.76 | J/mol×K | 543.64 | Joback Calculated Property |
| Cp,gas | 414.76 | J/mol×K | 575.39 | Joback Calculated Property |
| Cp,gas | 428.89 | J/mol×K | 607.13 | Joback Calculated Property |
| Cp,gas | 442.19 | J/mol×K | 638.87 | Joback Calculated Property |
| Cp,gas | 454.68 | J/mol×K | 670.61 | Joback Calculated Property |
| η | [0.0002041; 0.0121066] | Pa×s | [249.63; 480.16] |
|
| η | 0.0121066 | Pa×s | 249.63 | Joback Calculated Property |
| η | 0.0038941 | Pa×s | 288.05 | Joback Calculated Property |
| η | 0.0016358 | Pa×s | 326.47 | Joback Calculated Property |
| η | 0.0008249 | Pa×s | 364.89 | Joback Calculated Property |
| η | 0.0004739 | Pa×s | 403.32 | Joback Calculated Property |
| η | 0.0002998 | Pa×s | 441.74 | Joback Calculated Property |
| η | 0.0002041 | Pa×s | 480.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanoic acid, 2,2,3,3-tetramethyl, ethyl ester.
Sources
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