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(-)-Glutamic Acid
CAS: 6893-26-1 | C5H9NO4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
6893-26-1
Molecular Formula:
C5H9NO4
Molecular Mass:
147.13 g/mol
Names and Synonyms:
(-)-Glutamic Acid
D-Glutamic acid
Glutamic acid, D-
(R)-(-)-Glutamic acid
(R)-Glutamic acid
(2R)-2-Aminopentanedioic acid
(-)-Glutamic acid
D-(-)-Glutamic acid
(2R)-Glutamic acid
NSC 77686
(2R)-2-Aminopentanedioic acid
Identifiers:
SMILES:
N[C@H](CCC(=O)O)C(=O)O
InChI:
InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m1/s1
Key Properties
Melting Point
201 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 147.13 g/mol | CAS Common Chemistry |
| 147.053157768 g/mol | RDKit | |
| Canonical SMILES | O=C(O)CCC(N)C(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m1/s1 | CAS Common Chemistry |
| InChI Key | InChIKey=WHUUTDBJXJRKMK-GSVOUGTGSA-N | CAS Common Chemistry |
| Melting Point | 201 °C | CAS Common Chemistry |
| Name | (-)-Glutamic acid | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 100.62000000000002 Ų | RDKit |
| LogP | -0.7368999999999997 | RDKit |
| Molar Refractivity | 32.480999999999995 | RDKit |
