4-[(S)-Hydroxy-[(2R)-Piperidin-2-Yl]Methyl]Benzene-1,2-Diol Hydrobromide
[CAS# 31842-61-2]

Identification

• Name: 4-[(S)-Hydroxy-[(2R)-Piperidin-2-Yl]Methyl]Benzene-1,2-Diol Hydrobromide
• Synonyms: 4-[(S)-Hydroxy-[(2R)-2-Piperidyl]Methyl]Benzene-1,2-Diol Hydrobromide; 4-[(S)-Hydroxy-[(2R)-2-Piperidinyl]Methyl]Benzene-1,2-Diol Hydrobromide; 4-[(S)-Hydroxy-[(2R)-2-Piperidyl]Methyl]Pyrocatechol Hydrobromide
• Molecular Formula: C₁₂H₁₈BrNO₃
• Molecular Weight: 304.18
• CAS Registry Number: 31842-61-2
• EINECS: 250-834-6
• SMILES: [C@H]1(NCCCC1)[C@@H](O)C2=CC(=C(O)C=C2)O.[H+].[Br-]
• InChI: 1S/C12H17NO3.BrH/c14-10-5-4-8(7-11(10)15)12(16)9-3-1-2-6-13-9;/h4-5,7,9,12-16H,1-3,6H2;1H/t9-,12+;/m1./s1
• InChIKey: QPYZEEKXUYXZBK-KATIXKQHSA-N

Properties

• Boiling point: 435.6°C at 760 mmHg (Cal.)
• Flash point: 188.5°C (Cal.)