- InChI
- InChI=1S/C7H15NO2/c1-3-4-5(2)6(8)7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)
- InChI Key
- KWSUGULOZFMUDH-UHFFFAOYSA-N
- Formula
- C7H15NO2
- SMILES
- CCCC(C)C(N)C(=O)O
- Molecular Weight1
- 145.20
- CAS
- 60182-96-9
- 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 | 0.6833 | Relay (1.0) Calculated Property | |
| ΔfG° | -196.11 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -524.26 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 17.72 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 73.13 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.26 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.835 | Crippen Calculated Property | |
| McVol | 126.910 | ml/mol | McGowan Calculated Property |
| Pc | 3620.24 | kPa | Joback Calculated Property |
| Tboil | 496.86 | K | Relay (1.0) Calculated Property |
| Tc | 684.73 | K | Relay (1.0) Calculated Property |
| Tfus | 433.06 | K | Relay (1.0) Calculated Property |
| Vc | 0.427 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [320.89; 376.84] | J/mol×K | [577.26; 763.93] | 
|
| Cp,gas | 320.89 | J/mol×K | 577.26 | Joback Calculated Property |
| Cp,gas | 331.46 | J/mol×K | 608.37 | Joback Calculated Property |
| Cp,gas | 341.51 | J/mol×K | 639.48 | Joback Calculated Property |
| Cp,gas | 351.06 | J/mol×K | 670.59 | Joback Calculated Property |
| Cp,gas | 360.12 | J/mol×K | 701.70 | Joback Calculated Property |
| Cp,gas | 368.71 | J/mol×K | 732.82 | Joback Calculated Property |
| Cp,gas | 376.84 | J/mol×K | 763.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (1-Methylbutyl) glycine.
Sources
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