8-[(2S)-2-Hydroxy-3-Methylbut-3-Enyl]-5,7-Dimethoxychromen-2-One
[CAS# 77790-53-5]

Identification

• Name: 8-[(2S)-2-Hydroxy-3-Methylbut-3-Enyl]-5,7-Dimethoxychromen-2-One
• Synonyms: 8-[(2S)-2-Hydroxy-3-Methyl-But-3-Enyl]-5,7-Dimethoxy-Chromen-2-One; 8-[(2S)-2-Hydroxy-3-Methylbut-3-Enyl]-5,7-Dimethoxy-2-Chromenone; 8-[(2S)-2-Hydroxy-3-Methyl-But-3-Enyl]-5,7-Dimethoxy-Coumarin
• Molecular Formula: C₁₆H₁₈O₅
• Molecular Weight: 290.32
• CAS Registry Number: 77790-53-5
• SMILES: [C@H](CC1=C(OC)C=C(C2=C1OC(C=C2)=O)OC)(C(=C)C)O
• InChI: 1S/C16H18O5/c1-9(2)12(17)7-11-14(20-4)8-13(19-3)10-5-6-15(18)21-16(10)11/h5-6,8,12,17H,1,7H2,2-4H3/t12-/m0/s1
• InChIKey: NUABNGXDPYIGQM-LBPRGKRZSA-N

Properties

• Density: 1.209g/cm³ (Cal.)
• Boiling point: 486.319°C at 760 mmHg (Cal.)
• Flash point: 179.876°C (Cal.)