Basic Information |
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Product Name: | THUJONE |
CAS: | 76231-76-0 ;471-15-8 |
English Synonyms: | ALPHA,BETA-THUJONE ; (-)-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE ; ALPHA- AND BETA-THUJONE ; A,BETA-THUJONE ; THUJONE, (ALPHA, BETA)- ; THUJONE ; THUJONE A AND B ; ALPHA- AND BETA-1-ISOPROPYL-4-METHYLBICYCLO[3.1.0]HEXAN-3-ONE ; SG ; ALPHA,THUJONE, BETA-THUJONE, FENCHONE |
MDL Number.: | MFCD00135597 |
H bond acceptor: | 1 |
H bond donor: | 0 |
Smile: | C[C@H]1[C@H]2C[C@]2(CC1=O)C(C)C.C[C@@H]1[C@H]2C[C@]2(CC1=O)C(C)C |
InChi: | InChI=1S/2C10H16O/c2*1-6(2)10-4-8(10)7(3)9(11)5-10/h2*6-8H,4-5H2,1-3H3/t7-,8+,10-;7-,8-,10+/m01/s1 |
InChiKey: | InChIKey=AKPBIVZAUPVDMO-APEKEWONSA-N |
Property |
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Boiling Point: | 84-86 DEG C/17 MMHG(LIT) |
Density: | 0.925g/mLat25°C(lit.) |
Physical Property: | FLASHPOINT: 147.2 DEG F FLASHPOINT: 64 DEG C REFRACTIVE INDEX: N20/D 1.455(LIT) REFRACTIVE INDEX: N20/D 1.46 |
Comments: | ASSAY METHOD: APPROX 10% BETA-THUJONE BASIS ASSAY METHOD: APPROX 70% ALPHA-THUJONE BASIS PREPARATION NOTE: ISOLATED FROM NATURAL OIL OF CEDAR-LEAVES RIDADR: UN 2810 6.1/PG 3 STORAGE TEMPERATURE: 2-8 DEG C UNSPSC: 12352100 WGK: 3 |
Specification: | TECHNICAL GRADE |
Safety information |
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Symbol: | GHS06 GHS08 |
Signal word: | Danger |
Hazard statements: | H301-H311-H315-H317-H319-H331-H334-H335 |
Precautionary statements: | P261-P280-P301 + P310-P305 + P351 + P338-P311 |
hazard symbol: | T |
Risk Code: | R:23/24/25-36/37/38-42/43 |
Safe Code: | S:23-26-36/37/39-45 |
WGK Germany: | 3 |
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