- InChI
- InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t5-/m1/s1
- InChI Key
- RFMMMVDNIPUKGG-RXMQYKEDSA-N
- Formula
- C7H11NO5
- SMILES
- CC(=O)NC(CCC(=O)O)C(=O)O
- Molecular Weight1
- 189.17
- CAS
- 1188-37-0
- Other Names
-
- 2-acetamidopentanedioic acid
- Acetyl-L-glutamic acid
- L-Glutamic acid, N-acetyl-
- N-acetylglutamic acid
- 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 | 0.8770 | Relay (1.0) Calculated Property | |
| ΔfG° | -565.39 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -985.73 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.44 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 112.70 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.28 | eV | Relay (1.0) Calculated Property |
| log10WS | -0.71 | Aq. Solubility Prediction | |
| logPoct/wat | -0.559 | Crippen Calculated Property | |
| McVol | 135.920 | ml/mol | McGowan Calculated Property |
| Pc | 4468.24 | kPa | Joback Calculated Property |
| Tboil | 549.17 | K | Relay (1.0) Calculated Property |
| Tc | 806.53 | K | Relay (1.0) Calculated Property |
| Tfus | 424.48 | K | Relay (1.0) Calculated Property |
| Vc | 0.473 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [377.61; 414.00] | J/mol×K | [755.26; 941.96] | 
|
| Cp,gas | 377.61 | J/mol×K | 755.26 | Joback Calculated Property |
| Cp,gas | 384.78 | J/mol×K | 786.38 | Joback Calculated Property |
| Cp,gas | 391.49 | J/mol×K | 817.49 | Joback Calculated Property |
| Cp,gas | 397.75 | J/mol×K | 848.61 | Joback Calculated Property |
| Cp,gas | 403.58 | J/mol×K | 879.72 | Joback Calculated Property |
| Cp,gas | 408.99 | J/mol×K | 910.84 | Joback Calculated Property |
| Cp,gas | 414.00 | J/mol×K | 941.96 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N-Acetyl-L-glutamic acid.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Joback Method
- Aqueous Solubility Prediction Method
- McGowan Method
- NIST Webbook
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