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CAS No.: | 69630-50-8 |
---|---|
Name: | D-ASPARTIC ACID DIMETHYL ESTER HYDROCHLORIDE |
Article Data: | 16 |
Molecular Structure: | |
Formula: | C6H12ClNO4 |
Molecular Weight: | 197.619 |
Synonyms: | D-Asparticacid, dimethyl ester, hydrochloride (9CI);Dimethyl D-aspartate hydrochloride; |
EINECS: | 1533716-785-6 |
Melting Point: | 114-119℃ |
PSA: | 78.62000 |
LogP: | 0.55210 |
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The CAS register number of D-Aspartic acid,1,4-dimethyl ester, hydrochloride (1:1) is 69630-50-8. It also can be called as Dimethyl D-aspartate hydrochloride and the systematic name about this chemical is dimethyl (2R)-2-aminobutanedioate hydrochloride. The molecular formula about this chemical is C6H12ClNO4 and the molecular weight is 197.62. It belongs to the following product categories which include Amino Acids Derivatives; Amino ester; Amino hydrochloride and so on.
You can still convert the following datas into molecular structure:
(1)SMILES: COC(=O)C[C@H](C(=O)OC)N.Cl
(2)InChI: InChI=1/C6H11NO4.ClH/c1-10-5(8)3-4(7)6(9)11-2;/h4H,3,7H2,1-2H3;1H/t4-;/m1./s1
(3)InChIKey: PNLXWGDXZOYUKB-PGMHMLKABH
(4)Std. InChI: InChI=1S/C6H11NO4.ClH/c1-10-5(8)3-4(7)6(9)11-2;/h4H,3,7H2,1-2H3;1H/t4-;/m1./s1
(5)Std. InChIKey: PNLXWGDXZOYUKB-PGMHMLKASA-N