CAS
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Specification
The molecular formula is C6H13NO2.
The molecular weight is 131.17 g/mol.
The IUPAC name is (2R)-2-(propan-2-ylamino)propanoic acid.
The InChIKey is LABFFVKLPSJCAN-RXMQYKEDSA-N.
The canonical SMILES is CC(C)NC(C)C(=O)O.
The compound has 2 hydrogen bond donor count.
The compound has 3 hydrogen bond acceptor count.
The compound has 3 rotatable bond count.
The exact mass is 131.094628657 g/mol.
Yes, the compound is canonicalized.