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472247 Sigma-Aldrich

N-[3-(Acetylthio)-(2S)-methylpropionyl]-L-proline hydrate

97%

  • CAS Number 64838-55-7

  • Empirical Formula (Hill Notation) C11H17NO4S · xH2O

  • Molecular Weight 259.32 (anhydrous basis)

  •  EC Number 265-250-7

  •  MDL number MFCD07809564

  •  PubChem Substance ID 24870792

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Properties

assay   97%
optical activity   [α]21/D −158°, c = 1 in methanol
mp   76-82 °C (lit.)
SMILES string   O.C[C@H](CSC(C)=O)C(=O)N1CCC[C@H]1C(O)=O
InChI   1S/C11H17NO4S.H2O/c1-7(6-17-8(2)13)10(14)12-5-3-4-9(12)11(15)16;/h7,9H,3-6H2,1-2H3,(H,15,16);1H2/t7-,9+;/m1./s1
InChI key   WOOVUTUKNLXXPF-JXLXBRSFSA-N
Safety & Documentation

Safety Information

Symbol 
GHS07  GHS07
Signal word 
Warning
Hazard statements 
Precautionary statements 
WGK Germany 
3

Documents

Certificate of Analysis (COA)

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