(1S,4R)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE ,1125-12-8

(1S,4R)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE

Basic Information
Product Name：	(1S,4R)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE
CAS：	1125-12-8 ;546-80-5 ;76231-76-0
English Synonyms：	ALPHA-(-)-THUJONE ; THUJONE, ALPHA-(-)- ; THUJONE ; ALPHA-THUJONE ; EMOLECULES 494536 ; (-)-ALPHA-THUJONE ; (1S,4R)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE ; A-(-)-THUJONE ; (-)-3-ISOTHUJONE ; ALPHA+BETA-THUJONE ; L-THUJONE ; THUJON
MDL Number.：	MFCD00001313
H bond acceptor：	1
H bond donor：	0
Smile：	[H][C@]12C[C@]1(CC(=O)[C@@H]2C)C(C)C
InChi：	InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1
InChiKey：	InChIKey=USMNOWBWPHYOEA-MRTMQBJTSA-N
Property
Density：	0.914g/mLat20°C(lit.)
Physical Property：	FLASHPOINT: 147.2 DEG F FLASHPOINT: 64 DEG C REFRACTIVE INDEX: N20/D 1.450
Comments：	ASSAY METHOD: GC BIOCHEM/PHYSIOL ACTIONS: GABAA RECEPTOR ANTAGONIST OPTICAL ACTIVITY: [ALPHA]20/D -19.0+/-2.0 DEG, NEAT OTHER NOTES: CHIRAL BUILDING BLOCK RTECS: XO9625000 STORAGE TEMPERATURE: 2-8 DEG C UNSPSC: 12352100 WGK: 3
Safety information
Symbol：	GHS07
Signal word：	Warning
Hazard statements：	H302
hazard symbol：	Xn
Risk Code：	R:22
WGK Germany：	3

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