Scutellarin

About This Item

Molecular Formula	C₂₁H₁₈O₁₂
CAS Number	27740-01-8

FC-0631735

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Properties

Chemical Identifiers

IUPAC Name	(2S,3S,4S,5R,6S)-6-[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
SMILES	C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O)O)O
InChI Key	DJSISFGPUUYILV-ZFORQUDYSA-N
InChI	InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)10-5-9(23)13-11(31-10)6-12(14(24)15(13)25)32-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-22,24-28H,(H,29,30)/t16-,17-,18+,19-,21+/m0/s1

Physical Properties

Boiling Point	891.6±65.0 °C at 760 mmHg
Flash Point	314.9±27.8 °C
Density	1.8±0.1 g/cm3

Safety Information

Flash Point

314.9±27.8 °C

Please refer to the Safety Data Sheet (SDS) for complete handling, storage, and disposal instructions. Follow all applicable regulations when working with this chemical reagent.