[1S-(1α,4α,5α)]-4-甲基-1-(1-甲基乙基)二环[3.1.0]己烷-3-酮

pro_cas
76231-76-0 ;1125-12-8 ;546-80-5
pro_cdbregno
CCD00001289
pro_formula
C10H16O
pro_molWeight
152.235

basic_info

Product_Name: [1S-(1α,4α,5α)]-4-甲基-1-(1-甲基乙基)二环[3.1.0]己烷-3-酮
CAS: 76231-76-0 ;1125-12-8 ;546-80-5
中文同义词: ,5&alpha ; ,4&alpha ; )]-4-甲基-1-(1-甲基乙基)二环[3.1.0]己烷-3-酮 ; 侧柏酮(Α-和Β-位的混合物) ; [1S-(1α,4α,5α)]-4-甲基-1-(1-甲基乙基)二环[3.1.0]己烷-3-酮 ; [1S-(1α,4α,5α)]-4-甲基-1-(1-甲基乙基)二环[3.1.0]己烷-3-酮 ; [1S-(1&alpha ; α,β-侧柏酮
EnglishSynonyms: ALPHA-THUJONE ; (-)-3-ISOTHUJONE ; A-(-)-THUJONE ; (1S,4R)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE ; THUJONE ; THUJONE, ALPHA-(-)- ; ALPHA+BETA-THUJONE ; L-THUJONE ; ALPHA-(-)-THUJONE ; EMOLECULES 494536 ; (-)-ALPHA-THUJONE ; THUJON
pro_mdlNumber: MFCD00001313
pro_acceptors: 1
pro_donors: 0
pro_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.)
PhysicalProperty: 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

secure_info

secure_symbol: GHS07 GHS07
secure_signal_word: Warning
secure_risk_stmt: H302
secure_damage_code: Xn
secure_risk_disclosure_stmt: R:22
secure_wgk_germany: 3

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