76231-76-0
76231-76-0 结构式
基本信息
中文别名
Α,Β-侧柏酮Α,Β-侧柏酮
Α,Β-侧柏酮/GC
(-)-1-异丙基-4-甲基双环[3.1.0]己-3-酮
英文别名
α,β-Thujoneβ-thujone, 2-10%
α-thujone, 90-98%
THUJONE, (alpha, beta)-(SG)
(1S,5R)-1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-one
Bicyclo[3.1.0]hexan-3-one, 4-methyl-1-(1-methylethyl)-, (1S,5R)-
alpha,beta-Thujone technical, ~70% alpha-thujone basis, ~10% beta-thujone basis
物理化学性质
沸点84-86 °C/17 mmHg (lit.)
密度0.925 g/mL at 25 °C (lit.)
折射率n20/D 1.455(lit.)
闪点64 °C
储存条件2-8°C
溶解度Chloroform (Slightly), Dichloromethane (Slightly), DMSO (Slightly)
形态Oil
颜色Colourless
InChI1S/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
InChIKeyAKPBIVZAUPVDMO-APEKEWONSA-N
SMILESCC(C)[C@@]12C[C@@H]1[C@@H](C)C(=O)C2.CC(C)[C@@]34C[C@@H]3[C@H](C)C(=O)C4
安全数据
危险品标志T
危险品运输编号UN 2810 6.1/PG 3
WGK Germany3
存储类别6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
toxic compounds or compounds which causing chronic effects
危险性类别Acute Tox. 4 Oral