121080-63-5 Purity
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Specification
The molecular formula is C9H11NO.
The synonyms include (3S)-3-Amino-2,3-dihydro-1H-inden-5-ol, (S)-3-AMINO-2,3-DIHYDRO-1H-INDEN-5-OL, and (1S)-6-Hydroxy-2,3-dihydro-1H-inden-1-amine.
The molecular weight is 149.19 g/mol.
The IUPAC name is (3S)-3-amino-2,3-dihydro-1H-inden-5-ol.
The InChI is InChI=1S/C9H11NO/c10-9-4-2-6-1-3-7(11)5-8(6)9/h1,3,5,9,11H,2,4,10H2/t9-/m0/s1.
The InChIKey is MOUPGBDOLGDVNW-VIFPVBQESA-N.
The canonical SMILES is C1CC2=C(C1N)C=C(C=C2)O.
The CAS number is 1213899-46-7.
Yes, (S)-3-Amino-5-hydroxyindane is a canonicalized compound.