2157-24-6 Purity
98%
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Specification
The molecular formula is C5H12N2O3S.
The synonyms are 21752-31-8, (R-(R*,S*))-S-(3-Amino-3-carboxypropyl)-S-methylsulphoximide, (2S,5R)-methionine sulfoximine, and (2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACID.
The molecular weight is 180.23 g/mol.
It was created on March 26, 2008, and last modified on October 21, 2023.
The IUPAC Name is (2S)-2-amino-4-(methylsulfonimidoyl)butanoic acid.
The InChI is InChI=1S/C5H12N2O3S/c1-11(7,10)3-2-4(6)5(8)9/h4,7H,2-3,6H2,1H3,(H,8,9)/t4-,11+/m0/s1.
The InChIKey is SXTAYKAGBXMACB-AQPAIEDISA-N.
The Canonical SMILES is CS(=N)(=O)CCC(C(=O)O)N.
The CAS number is 21752-31-8.
The XLogP3 value is -1.8.