Brassicasterol

About This Item

Molecular Formula	C₂₈H₄₆O
CAS Number	474-67-9
Appearance	Solid

FC-0662941

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Properties

Chemical Identifiers

IUPAC Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
SMILES	CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
InChI Key	OILXMJHPFNGGTO-ZAUYPBDWSA-N
InChI	InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1

Physical Properties

Boiling Point	488.7±14.0 °C at 760 mmHg
Melting Point	150 - 151 °C
Flash Point	213.3±12.4 °C
Density	1.0±0.1 g/cm3

Safety Information

Hazard Class

Warning

Flash Point

213.3±12.4 °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.