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α,β-Thujone

Catalog No. 283118 Name Sigma Aldrich
CAS Number 76231-76-0 Website http://www.sigmaaldrich.com
M. F. C20H32O2 Telephone 1-800-521-8956
M. W. 304.46688 Fax
Purity Email
Storage Chembase ID: 148727

SYNONYMS

Title
α,β-侧柏酮
IUPAC name
(1S,4R,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one; (1S,4S,5R)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
IUPAC Traditional name
(+)-β-thujone; thujone
Synonyms
(-)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
(-)-1-异丙基-4-甲基双环[3.1.0]己-3-酮

DATABASE IDS

MDL Number MFCD00135597
PubChem SID 24857084
CAS Number 76231-76-0

PROPERTIES

Empirical Formula (Hill Notation) C10H16O
Grade technical grade
Impurities 1.2% limonene
Impurities 17.8% fenchone
Impurities 2.0% p-cymene
Boiling Point 84-86 °C/17 mmHg(lit.)
Density 0.925 g/mL at 25 °C(lit.)
Flash Point 64 °C
Flash Point 147.2 °F
Optical Rotation [α]20/D -15°, neat
Refractive Index n20/D 1.455(lit.)
GHS Pictograms GHS06
GHS Pictograms GHS08
GHS Signal Word Danger
GHS Hazard statements H301-H311-H315-H317-H319-H331-H334-H335
European Hazard Symbols Toxic Toxic (T)
MSDS Link Download
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
GHS Precautionary statements P261-P280-P301 + P310-P305 + P351 + P338-P311
RID/ADR UN 2810 6.1/PG 3
Risk Statements 23/24/25-36/37/38-42/43
Safety Statements 23-26-36/37/39-45
Hazard Class 6.1
UN Number 2810
Packing Group 3
German water hazard class 3

DETAILS

Description (English)
Packaging
5 g in glass bottle
Description (简体中文)
包装
5 g in glass bottle

REFERENCES