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经验公式(希尔记法):
C13H18O3
化学文摘社编号:
分子量:
222.28
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
22307543
SMILES string
CC(C)C(O)c1ccc(cc1)C(C)C(O)=O
InChI key
RMOQYHYFRKTDRI-UHFFFAOYSA-N
InChI
1S/C13H18O3/c1-8(2)12(14)11-6-4-10(5-7-11)9(3)13(15)16/h4-9,12,14H,1-3H3,(H,15,16)
assay
≥98.0% (HPLC)
shelf life
limited shelf life, expiry date on the label
impurities
≤0.5% water
application(s)
forensics and toxicology
pharmaceutical (small molecule)
format
neat
Quality Level
signalword
Warning
hcodes
pcodes
Hazard Classifications
Acute Tox. 4 Oral
存储类别
11 - Combustible Solids
wgk
WGK 3
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