SMILES string
O([C@H]1[C@@H](CC[C@H](C1)C)C(C)C)C(=O)C
InChI
1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3/t9-,11+,12-/m1/s1
InChI key
XHXUANMFYXWVNG-ADEWGFFLSA-N
assay
≥97.0% (GC)
form
liquid
potency
>5000 mg/kg LD50, oral (Rat), >5000 mg/kg LD50, skin (Rabbit)
density
0.925 g/cm3
storage temp.
2-30°C
Quality Level
Analysis Note
Assay (GC, area%): ≥ 97.0 % (a/a)
Density (d 20 °C/ 4 °C): 0.923 - 0.928
Spec. rotation [α²0/D (c=8 in chloroform): -93.0 - -83.0 °
Identity (IR): passes test
Density (d 20 °C/ 4 °C): 0.923 - 0.928
Spec. rotation [α²0/D (c=8 in chloroform): -93.0 - -83.0 °
Identity (IR): passes test
hcodes
pcodes
Hazard Classifications
Aquatic Chronic 2
存储类别
10 - Combustible liquids
wgk
WGK 2
flash_point_f
170.6 °F - closed cup
flash_point_c
77 °C - closed cup
法规信息
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