- InChI
- InChI=1S/C7H15NO2/c1-4(2)5(3)6(8)7(9)10/h4-6H,8H2,1-3H3,(H,9,10)
- InChI Key
- VFEDCKXLINRKLV-UHFFFAOYSA-N
- Formula
- C7H15NO2
- SMILES
- CC(C)C(C)C(N)C(=O)O
- Molecular Weight1
- 145.20
- CAS
- 19531-09-0
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- 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 | 0.6546 | Relay (... Calculated Property | |
| ΔfG° | -198.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -515.48 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 14.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.40 | kJ/mol | Relay (... Calculated Property |
| IE | 8.74 | eV | Relay (... Calculated Property |
| log10WS | -1.19 | Relay (... Calculated Property | |
| logPoct/wat | 0.690 | Crippen Calculated Property | |
| McVol | 126.910 | ml/mol | McGowan Calculated Property |
| Pc | 3655.35 | kPa | Joback Calculated Property |
| Tboil | 495.22 | K | Relay (... Calculated Property |
| Tc | 682.31 | K | Relay (... Calculated Property |
| Tfus | 437.61 | K | Relay (... Calculated Property |
| Vc | 0.417 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [321.31; 378.39] | J/mol×K | [576.82; 767.06] | 
|
| Cp,gas | 321.31 | J/mol×K | 576.82 | Joback Calculated Property |
| Cp,gas | 332.13 | J/mol×K | 608.53 | Joback Calculated Property |
| Cp,gas | 342.41 | J/mol×K | 640.23 | Joback Calculated Property |
| Cp,gas | 352.16 | J/mol×K | 671.94 | Joback Calculated Property |
| Cp,gas | 361.40 | J/mol×K | 703.65 | Joback Calculated Property |
| Cp,gas | 370.13 | J/mol×K | 735.36 | Joback Calculated Property |
| Cp,gas | 378.39 | J/mol×K | 767.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (3-Methylbut-2-yl) glycine.
Sources
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