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Cas Database |
| Name |
L-Proline, 5-oxo-,calcium salt (2:1) |
EINECS | 250-602-4 |
| CAS No. | 31377-05-6 | Density | 0.001g/cm3 at 20℃ |
| PSA | 110.80000 | LogP | -0.79740 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C10H12CaN2O6 | Boiling Point | 453.1oC at 760 mmHg |
| Molecular Weight | 296.293 | Flash Point | 227.8oC |
| Transport Information | N/A | Appearance | White crystalline powder |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Proline,5-oxo-, calcium salt (2:1), L- (8CI);5-Oxo-L-proline calcium salt;Calciumpidolate;Efical;Pidolic acid calcium salt (2:1);calcium bis[(2S)-5-oxopyrrolidine-2-carboxylate];L-proline, 5-oxo-, calcium salt (2:1); |
Article Data | 1 |
L-Proline, 5-oxo-,calcium salt (2:1) Specification
The L-Proline, 5-oxo-,calcium salt (2:1), with the CAS registry number 31377-05-6 and EINECS registry number 250-602-4, has the systematic name of calcium bis[(2S)-5-oxopyrrolidine-2-carboxylate]. And the molecular formula of the chemical is C10H12CaN2O6.
The characteristics of L-Proline, 5-oxo-,calcium salt (2:1) are as followings: (1)#H bond acceptors: 8; (2)#H bond donors: 4; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 138.46 Å2.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Ca+2].[O-]C(=O)[C@@H]1CCC(=O)N1.[O-]C(=O)[C@@H]1CCC(=O)N1
(2)InChI: InChI=1/2C5H7NO3.Ca/c2*7-4-2-1-3(6-4)5(8)9;/h2*3H,1-2H2,(H,6,7)(H,8,9);/q;;+2/p-2/t2*3-;/m00./s1
(3)InChIKey: YQFZERWESBDNRJ-GWBJQCFQBX
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