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Basic Information
| CAS No.: | 39162-75-9 |
|---|---|
| Name: | Calcium dihydrogen di-L-aspartate |
| Molecular Structure: | |
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| Formula: | 2(C4H6NO4).Ca |
| Molecular Weight: | 304.27 |
| Synonyms: | Asparticacid calcium salt (2:1);Calcium diaspartate;L-Aspartic acid calcium salt; |
| EINECS: | 254-327-0 |
| Melting Point: | 270-271oC |
| PSA: | 179.24000 |
| LogP: | -1.00760 |
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Calcium dihydrogen di-L-aspartate
Specification
The Calcium dihydrogen di-L-aspartate, also known as L-Aspartic acid calcium salt, is an organic compound with the formula 2(C4H6NO4).Ca. Its EINECS registry number is 254-327-0. With the CAS registry number 39162-75-9, its systematic name is butanedioate, 2-amino-, calcium hydrogen salt, (2S)- (2:1:2).
You can still convert the following datas into molecular structure:
(1)SMILES: [H+].[H+].C([C@@H](C(=O)[O-])N)C(=O)[O-].C([C@@H](C(=O)[O-])N)C(=O)[O-].[Ca+2]
(2)InChI: InChI=1/2C4H7NO4.Ca/c2*5-2(4(8)9)1-3(6)7;/h2*2H,1,5H2,(H,6,7)(H,8,9);/q;;+2/p-2/t2*2-;/m00./s1
(3)InChIKey: VAFAEQCKZBKRLZ-PWCSPVDTBQ