Neohesperidin

About This Item

Molecular Formula	C₂₈H₃₄O₁₅
CAS Number	13241-33-3

FC-0646144

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Properties

Chemical Identifiers

IUPAC Name	(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-2,3-dihydrochromen-4-one
SMILES	C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC(=C(C=C5)OC)O)O)CO)O)O)O)O)O
InChI Key	ARGKVCXINMKCAZ-UZRWAPQLSA-N

Physical Properties

Boiling Point	933.7±65.0 °C at 760 mmHg
Melting Point	239-243ºC
Flash Point	306.7±27.8 °C
Density	1.7±0.1 g/cm3

Safety Information

Flash Point

306.7±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.