84877-71-4 Purity
97%
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The molecular formula is C7H13NO3.
The synonyms are (2R)-2-Amino-3-(tetrahydrofuran-3-yl)propanoic acid, (2R)-2-AMINO-3-(OXOLAN-3-YL)PROPANOIC ACID, and 3-Oxolan-3-yl-D-alanine.
The molecular weight is 159.18 g/mol.
The IUPAC name is (2R)-2-amino-3-(oxolan-3-yl)propanoic acid.
The InChI is InChI=1S/C7H13NO3/c8-6(7(9)10)3-5-1-2-11-4-5/h5-6H,1-4,8H2,(H,9,10)/t5?,6-/m1/s1.
The InChIKey is OTUZUAJROYEUAS-PRJDIBJQSA-N.
The canonical SMILES is C1COCC1CC(C(=O)O)N.
The isomeric SMILES is C1COCC1C[C@H](C(=O)O)N.
The CAS number is 1344974-68-0 and the DSSTox Substance ID is DTXSID10743976.
The XLogP3-AA value is -2.8.