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Home >> Chemical Listing >> Page 2908 >> 2-Hydroxy-3-{1-[4-(methylsulfinyl)phenyl]-3-oxobutyl}-4H-chromen-4-one

2-Hydroxy-3-{1-[4-(methylsulfinyl)phenyl]-3-oxobutyl}-4H-chromen-4-one
[CAS# 89434-45-7]

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Identification
Name 2-Hydroxy-3-{1-[4-(methylsulfinyl)phenyl]-3-oxobutyl}-4H-chromen-4-one
Synonyms 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-(4-(methylsulfinyl)phenyl)-3-oxobutyl)-; Methylsulfinylwarfarin
Molecular Structure CAS#: 89434-45-7, 2-Hydroxy-3-{1-[4-(methylsulfinyl)phenyl]-3-oxobutyl}-4H-chromen-4-one
Molecular Formula C20H18O5S
Molecular Weight 370.42
CAS Registry Number 89434-45-7
SMILES O=S(c1ccc(cc1)C(C=2C(=O)c3c(OC=2O)cccc3)CC(=O)C)C
InChI 1S/C20H18O5S/c1-12(21)11-16(13-7-9-14(10-8-13)26(2)24)18-19(22)15-5-3-4-6-17(15)25-20(18)23/h3-10,16,23H,11H2,1-2H3
InChIKey KCVJKRCCAVPBPW-UHFFFAOYSA-N
Properties
Density 1.411g/cm3 (Cal.)
Boiling point 580.637°C at 760 mmHg (Cal.)
Flash point 304.959°C (Cal.)
Market Analysis Reports
List of Reports Available for 2-Hydroxy-3-{1-[4-(methylsulfinyl)phenyl]-3-oxobutyl}-4H-chromen-4-one
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