(2S)-6-(Dimethylaminomethyl)-5,7-Dihydroxy-2-Phenylchroman-4-One
[CAS# 183051-62-9]

Identification

• Name: (2S)-6-(Dimethylaminomethyl)-5,7-Dihydroxy-2-Phenylchroman-4-One
• Synonyms: (2S)-6-(Dimethylaminomethyl)-5,7-Dihydroxy-2-Phenyl-Chroman-4-One; (2S)-6-(Dimethylaminomethyl)-5,7-Dihydroxy-2-Phenyl-4-Chromanone; 6-Dimethylaminomethyl Pinocembrin
• Molecular Formula: C₁₈H₁₉NO₄
• Molecular Weight: 313.35
• CAS Registry Number: 183051-62-9
• SMILES: [C@@H]2(OC1=CC(=C(C(=C1C(=O)C2)O)CN(C)C)O)C3=CC=CC=C3
• InChI: 1S/C18H19NO4/c1-19(2)10-12-13(20)8-16-17(18(12)22)14(21)9-15(23-16)11-6-4-3-5-7-11/h3-8,15,20,22H,9-10H2,1-2H3/t15-/m0/s1
• InChIKey: YPDOAPAUMDTKKS-HNNXBMFYSA-N

Properties

• Density: 1.298g/cm³ (Cal.)
• Boiling point: 535.862°C at 760 mmHg (Cal.)
• Flash point: 277.879°C (Cal.)